data_6521 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Characterization of an amyloid fibril intermediate ; _BMRB_accession_number 6521 _BMRB_flat_file_name bmr6521.str _Entry_type original _Submission_date 2005-02-22 _Accession_date 2005-02-23 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Backbone residue assignments were used for H/D exchange, pKa and stability studies of p53tet-wt.' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Galea Charles A. . 2 Bowman Prentice . . 3 Kriwacki Richard W. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 98 "13C chemical shifts" 104 "15N chemical shifts" 98 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-01-29 original author . stop_ _Original_release_date 2007-01-29 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Disruption of an intermonomer salt bridge in the p53 tetramerization domain results in an increased propensity to form amyloid fibrils. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16260757 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Galea Charles A. . 2 Bowman Prentice . . 3 Kriwacki Richard W. . stop_ _Journal_abbreviation 'Protein Sci.' _Journal_volume 14 _Journal_issue 12 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 2993 _Page_last 3003 _Year 2005 _Details . loop_ _Keyword 'p53 tetramerization domain' 'tumor suppressor protein' 'H/D exchange' 'Amyloid fibril intermediate' pKa 'Nuclear Magnetic Resonance' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'p53 tetramer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'subunit A' $p53_tetramerization_domain_polypeptide 'subunit B' $p53_tetramerization_domain_polypeptide 'subunit C' $p53_tetramerization_domain_polypeptide 'subunit D' $p53_tetramerization_domain_polypeptide stop_ _System_molecular_weight 25060 _System_physical_state native _System_oligomer_state protein _System_paramagnetic no _System_thiol_state 'not present' loop_ _Magnetic_equivalence_ID _Magnetically_equivalent_system_component 1 'subunit A' 1 'subunit B' 1 'subunit C' 1 'subunit D' stop_ loop_ _Biological_function 'Transcription factor' 'Oligomerization domain' stop_ _Database_query_date . _Details Homotetramer save_ ######################## # Monomeric polymers # ######################## save_p53_tetramerization_domain_polypeptide _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common p53tet _Molecular_mass 6265 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 55 _Mol_residue_sequence ; GSHMNNTSSSPQPKKKPLDG EYFTLQIRGRERFEMFRELN EALELKDAQAGKEPG ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 6 GLY 2 7 SER 3 8 HIS 4 9 MET 5 10 ASN 6 11 ASN 7 12 THR 8 13 SER 9 14 SER 10 15 SER 11 16 PRO 12 17 GLN 13 18 PRO 14 19 LYS 15 20 LYS 16 21 LYS 17 22 PRO 18 23 LEU 19 24 ASP 20 25 GLY 21 26 GLU 22 27 TYR 23 28 PHE 24 29 THR 25 30 LEU 26 31 GLN 27 32 ILE 28 33 ARG 29 34 GLY 30 35 ARG 31 36 GLU 32 37 ARG 33 38 PHE 34 39 GLU 35 40 MET 36 41 PHE 37 42 ARG 38 43 GLU 39 44 LEU 40 45 ASN 41 46 GLU 42 47 ALA 43 48 LEU 44 49 GLU 45 50 LEU 46 51 LYS 47 52 ASP 48 53 ALA 49 54 GLN 50 55 ALA 51 56 GLY 52 57 LYS 53 58 GLU 54 59 PRO 55 60 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 4048 p53tet 92.73 66 100.00 100.00 7.71e-28 BMRB 6522 Mutant_p53_tetramerization_domain_polypeptide 100.00 54 98.18 98.18 1.45e-28 BMRB 7251 p53TD_wild_type 56.36 31 100.00 100.00 4.61e-12 PDB 1AIE "P53 Tetramerization Domain Crystal Structure" 56.36 31 100.00 100.00 4.61e-12 PDB 1C26 "Crystal Structure Of P53 Tetramerization Domain" 58.18 32 100.00 100.00 7.00e-13 PDB 1OLG "High-Resolution Solution Structure Of The Oligomerization Domain Of P53 By Multi-Dimensional Nmr" 76.36 42 100.00 100.00 2.42e-20 PDB 1OLH "High-Resolution Solution Structure Of The Oligomerization Domain Of P53 By Multi-Dimensional Nmr" 76.36 42 100.00 100.00 2.42e-20 PDB 1PES "Nmr Solution Structure Of The Tetrameric Minimum Transforming Domain Of P53" 56.36 31 100.00 100.00 4.61e-12 PDB 1PET "Nmr Solution Structure Of The Tetrameric Minimum Transforming Domain Of P53" 56.36 31 100.00 100.00 4.61e-12 PDB 1SAE "High Resolution Solution Nmr Structure Of The Oligomerization Domain Of P53 By Multi-Dimensional Nmr (Sac Structures)" 76.36 42 100.00 100.00 2.42e-20 PDB 1SAF "High Resolution Solution Nmr Structure Of The Oligomerization Domain Of P53 By Multi-Dimensional Nmr (Sad Structures)" 76.36 42 100.00 100.00 2.42e-20 PDB 1SAK "High Resolution Solution Nmr Structure Of The Oligomerization Domain Of P53 By Multi-Dimensional Nmr (Sac Structures)" 76.36 42 100.00 100.00 2.42e-20 PDB 1SAL "High Resolution Solution Nmr Structure Of The Oligomerization Domain Of P53 By Multi-Dimensional Nmr (Sad Structures)" 76.36 42 100.00 100.00 2.42e-20 PDB 2J0Z "P53 Tetramerization Domain Wild Type" 56.36 31 100.00 100.00 4.61e-12 PDB 3SAK "High Resolution Solution Nmr Structure Of The Oligomerization Domain Of P53 By Multi-Dimensional Nmr (Sac Structures)" 76.36 42 100.00 100.00 2.42e-20 DBJ BAC16799 "P53 [Homo sapiens]" 92.73 393 100.00 100.00 8.89e-26 DBJ BAD96746 "tumor protein p53 variant [Homo sapiens]" 92.73 158 100.00 100.00 6.88e-27 DBJ BAG35463 "unnamed protein product [Homo sapiens]" 92.73 393 100.00 100.00 9.34e-26 DBJ BAG59884 "unnamed protein product [Homo sapiens]" 92.73 368 100.00 100.00 9.04e-26 DBJ BAG60244 "unnamed protein product [Homo sapiens]" 92.73 383 100.00 100.00 1.00e-25 EMBL CAA25652 "p53 [Homo sapiens]" 92.73 293 100.00 100.00 4.37e-26 EMBL CAA26306 "unnamed protein product [Homo sapiens]" 92.73 393 100.00 100.00 9.43e-26 EMBL CAA34420 "unnamed protein product [Chlorocebus aethiops]" 92.73 393 98.04 98.04 4.27e-25 EMBL CAA38095 "protein p53 [Homo sapiens]" 92.73 393 100.00 100.00 9.34e-26 EMBL CAA42626 "p53 transformation suppressor [Homo sapiens]" 92.73 393 100.00 100.00 9.71e-26 GB AAA17994 "p53 [Macaca mulatta]" 92.73 393 98.04 98.04 4.23e-25 GB AAA59987 "phosphoprotein p53 [Homo sapiens]" 92.73 393 100.00 100.00 9.91e-26 GB AAA59988 "phosphoprotein p53 [Homo sapiens]" 92.73 393 100.00 100.00 9.43e-26 GB AAA59989 "p53 cellular tumor antigen [Homo sapiens]" 92.73 393 100.00 100.00 9.06e-26 GB AAA61211 "p53 antigen [Homo sapiens]" 92.73 393 100.00 100.00 9.24e-26 PRF 2006287A "p53 protein" 92.73 393 98.04 98.04 4.23e-25 REF NP_000537 "cellular tumor antigen p53 isoform a [Homo sapiens]" 92.73 393 100.00 100.00 9.43e-26 REF NP_001040616 "cellular tumor antigen p53 [Macaca mulatta]" 92.73 393 98.04 98.04 4.23e-25 REF NP_001119584 "cellular tumor antigen p53 isoform a [Homo sapiens]" 92.73 393 100.00 100.00 9.43e-26 REF NP_001119587 "cellular tumor antigen p53 isoform d [Homo sapiens]" 92.73 261 100.00 100.00 3.01e-26 REF NP_001119590 "cellular tumor antigen p53 isoform g [Homo sapiens]" 92.73 354 100.00 100.00 8.42e-26 SP P04637 "RecName: Full=Cellular tumor antigen p53; AltName: Full=Antigen NY-CO-13; AltName: Full=Phosphoprotein p53; AltName: Full=Tumor" 92.73 393 100.00 100.00 9.43e-26 SP P13481 "RecName: Full=Cellular tumor antigen p53; AltName: Full=Tumor suppressor p53 [Chlorocebus aethiops]" 92.73 393 98.04 98.04 4.27e-25 SP P56423 "RecName: Full=Cellular tumor antigen p53; AltName: Full=Tumor suppressor p53 [Macaca fascicularis]" 92.73 393 98.04 98.04 4.23e-25 SP P56424 "RecName: Full=Cellular tumor antigen p53; AltName: Full=Tumor suppressor p53 [Macaca mulatta]" 92.73 393 98.04 98.04 4.23e-25 SP P61260 "RecName: Full=Cellular tumor antigen p53; AltName: Full=Tumor suppressor p53 [Macaca fuscata fuscata]" 92.73 393 98.04 98.04 4.23e-25 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $p53_tetramerization_domain_polypeptide human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Variant _Vector_type _Vector_name _Vendor_name $p53_tetramerization_domain_polypeptide 'recombinant technology' 'E. coli' Escherichia coli BL21 DE3 plasmid pET28a Novagen stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $p53_tetramerization_domain_polypeptide 4.0 mM [U-15N] Na2HPO4 10 mM . NaCl 50 mM . NaN3 0.02 % . stop_ save_ save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $p53_tetramerization_domain_polypeptide 4.0 mM [U-15N] Na2HPO4 10 mM . NaCl 50 mM . NaN3 0.02 % . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $p53_tetramerization_domain_polypeptide 4.0 mM '[U-13C; U-15N]' Na2HPO4 10 mM . NaCl 50 mM . NaN3 0.02 % . stop_ save_ save_sample_4 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $p53_tetramerization_domain_polypeptide 4.0 mM '[U-13C; U-15N]' Na2HPO4 10 mM . NaCl 50 mM . NaN3 0.02 % . stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name Felix _Version . loop_ _Vendor _Address _Electronic_address Accelrys ; Accelrys, Inc. 10188 Telesis Court, Suite 100 San Diego, CA 92121 USA Phone: +1 858 799 5000 Fax: +1 858 799 5100 ; http://www.accelrys.com/ stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name 1H15N_HSQC _Sample_label . save_ save_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label . save_ save_HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CO)CA _Sample_label . save_ save_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label . save_ save_CBCA(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name CBCA(CO)NH _Sample_label . save_ save_1H15N_NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name 1H15N_NOESY _Sample_label . save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.0 0.05 pH temperature 293.0 0.1 K stop_ save_ save_conditions_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 4.0 0.05 pH temperature 293.0 0.1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis TSP H 1 'methyl protons' ppm 0.00 external indirect . . . stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details 'Assigned chemical shift values for wild type p53tet at pH 4.0.' loop_ _Software_label $software_1 stop_ loop_ _Experiment_label 1H15N_HSQC HNCA HN(CO)CA HNCACB CBCA(CO)NH 1H15N_NOESY stop_ loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'subunit A' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 8 3 HIS H H 8.502 . . 2 8 3 HIS N N 122.268 . . 3 9 4 MET H H 8.255 . . 4 9 4 MET CA C 55.34815 . . 5 9 4 MET N N 122.938 . . 6 10 5 ASN H H 8.412 . . 7 10 5 ASN N N 121.342 . . 8 11 6 ASN H H 8.322 . . 9 11 6 ASN CA C 53.32227 . . 10 11 6 ASN N N 120.806 . . 11 12 7 THR H H 8.05 . . 12 12 7 THR CA C 61.51926 . . 13 12 7 THR N N 115.352 . . 14 13 8 SER H H 8.211 . . 15 13 8 SER CA C 58.15683 . . 16 13 8 SER N N 119.157 . . 17 14 9 SER H H 8.181 . . 18 14 9 SER CA C 58.15683 . . 19 14 9 SER N N 118.938 . . 20 15 10 SER H H 8.113 . . 21 15 10 SER CA C 56.39097 . . 22 15 10 SER N N 120.121 . . 23 16 11 PRO CA C 63.03533 . . 24 17 12 GLN H H 7.936 . . 25 17 12 GLN N N 120.426 . . 26 19 14 LYS H H 8.268 . . 27 19 14 LYS CA C 56.30585 . . 28 19 14 LYS N N 123.222 . . 29 20 15 LYS H H 8.074 . . 30 20 15 LYS CA C 56.24077 . . 31 20 15 LYS N N 124.207 . . 32 21 16 LYS H H 7.956 . . 33 21 16 LYS CA C 54.23303 . . 34 21 16 LYS N N 123.097 . . 35 22 17 PRO CA C 63.08745 . . 36 23 18 LEU H H 8.218 . . 37 23 18 LEU CA C 55.11242 . . 38 23 18 LEU N N 123.28 . . 39 24 19 ASP H H 8.127 . . 40 24 19 ASP CA C 54.14381 . . 41 24 19 ASP N N 122.646 . . 42 25 20 GLY H H 8.091 . . 43 25 20 GLY CA C 44.89923 . . 44 25 20 GLY N N 110.296 . . 45 26 21 GLU H H 7.837 . . 46 26 21 GLU CA C 56.00053 . . 47 26 21 GLU N N 121.99 . . 48 27 22 TYR H H 7.827 . . 49 27 22 TYR CA C 57.3091 . . 50 27 22 TYR N N 121.256 . . 51 28 23 PHE H H 9.15 . . 52 28 23 PHE CA C 56.54295 . . 53 28 23 PHE N N 122.392 . . 54 29 24 THR H H 8.25 . . 55 29 24 THR CA C 61.41326 . . 56 29 24 THR N N 115.644 . . 57 30 25 LEU H H 8.791 . . 58 30 25 LEU CA C 53.30207 . . 59 30 25 LEU N N 128.02 . . 60 31 26 GLN H H 8.497 . . 61 31 26 GLN CA C 54.91596 . . 62 31 26 GLN N N 126.421 . . 63 32 27 ILE H H 9.24 . . 64 32 27 ILE CA C 59.33935 . . 65 32 27 ILE N N 127.865 . . 66 33 28 ARG H H 9.649 . . 67 33 28 ARG CA C 56.08375 . . 68 33 28 ARG N N 131.598 . . 69 34 29 GLY H H 8.55 . . 70 34 29 GLY CA C 44.89077 . . 71 34 29 GLY N N 116.299 . . 72 35 30 ARG H H 8.776 . . 73 35 30 ARG CA C 58.89011 . . 74 35 30 ARG N N 127.594 . . 75 36 31 GLU H H 8.688 . . 76 36 31 GLU CA C 60.3909 . . 77 36 31 GLU N N 119.714 . . 78 37 32 ARG H H 7.827 . . 79 37 32 ARG CA C 56.20694 . . 80 37 32 ARG N N 124.094 . . 81 38 33 PHE H H 8.255 . . 82 38 33 PHE CA C 61.97559 . . 83 38 33 PHE N N 121.67 . . 84 39 34 GLU H H 8.396 . . 85 39 34 GLU CA C 58.98247 . . 86 39 34 GLU N N 119.473 . . 87 40 35 MET H H 7.425 . . 88 40 35 MET CA C 58.9635 . . 89 40 35 MET N N 121.919 . . 90 41 36 PHE H H 7.86 . . 91 41 36 PHE CA C 60.76184 . . 92 41 36 PHE N N 119.043 . . 93 42 37 ARG H H 9.09 . . 94 42 37 ARG CA C 59.8272 . . 95 42 37 ARG N N 122.386 . . 96 43 38 GLU H H 7.75 . . 97 43 38 GLU CA C 59.45067 . . 98 43 38 GLU N N 121.564 . . 99 44 39 LEU H H 7.658 . . 100 44 39 LEU CA C 57.95821 . . 101 44 39 LEU N N 119.646 . . 102 45 40 ASN H H 8.649 . . 103 45 40 ASN CA C 57.1855 . . 104 45 40 ASN N N 118.448 . . 105 46 41 GLU H H 8.658 . . 106 46 41 GLU CA C 59.27851 . . 107 46 41 GLU N N 119.701 . . 108 47 42 ALA H H 7.959 . . 109 47 42 ALA CA C 55.25634 . . 110 47 42 ALA N N 123.333 . . 111 48 43 LEU H H 8.238 . . 112 48 43 LEU CA C 57.908 . . 113 48 43 LEU N N 121.453 . . 114 49 44 GLU H H 8.255 . . 115 49 44 GLU CA C 59.73648 . . 116 49 44 GLU N N 120.053 . . 117 50 45 LEU H H 8.041 . . 118 50 45 LEU CA C 57.76803 . . 119 50 45 LEU N N 125.08 . . 120 51 46 LYS H H 7.739 . . 121 51 46 LYS CA C 59.46336 . . 122 51 46 LYS N N 122.909 . . 123 52 47 ASP H H 8.109 . . 124 52 47 ASP CA C 56.73121 . . 125 52 47 ASP N N 121.535 . . 126 53 48 ALA H H 7.539 . . 127 53 48 ALA CA C 53.8565 . . 128 53 48 ALA N N 122.322 . . 129 54 49 GLN H H 7.729 . . 130 54 49 GLN CA C 56.5585 . . 131 54 49 GLN N N 118.236 . . 132 55 50 ALA H H 7.693 . . 133 55 50 ALA CA C 53.1205 . . 134 55 50 ALA N N 123.961 . . 135 56 51 GLY H H 8.06 . . 136 56 51 GLY CA C 45.36198 . . 137 56 51 GLY N N 108.609 . . 138 57 52 LYS H H 7.786 . . 139 57 52 LYS CA C 55.81595 . . 140 57 52 LYS N N 121.835 . . 141 58 53 GLU H H 8.283 . . 142 58 53 GLU CA C 54.3202 . . 143 58 53 GLU N N 126.176 . . 144 59 54 PRO CA C 63.18758 . . 145 60 55 GLY H H 7.879 . . 146 60 55 GLY CA C 46.29756 . . 147 60 55 GLY N N 116.629 . . stop_ save_ save_chem_shift_list_2 _Saveframe_category assigned_chemical_shifts _Details 'Assigned chemical shift values for wild type p53tet at pH 4.0.' loop_ _Software_label $software_1 stop_ loop_ _Experiment_label 1H15N_HSQC HNCA HN(CO)CA HNCACB CBCA(CO)NH 1H15N_NOESY stop_ loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $conditions_2 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'subunit A' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 6 1 GLY CA C 43.32384 . . 2 7 2 SER H H 8.478 . . 3 7 2 SER CA C 58.25784 . . 4 7 2 SER N N 116.745 . . 5 8 3 HIS H H 8.543 . . 6 8 3 HIS CA C 55.3554 . . 7 8 3 HIS N N 121.776 . . 8 9 4 MET H H 8.281 . . 9 9 4 MET CA C 55.45662 . . 10 9 4 MET N N 123.082 . . 11 10 5 ASN H H 8.399 . . 12 10 5 ASN CA C 53.22237 . . 13 10 5 ASN N N 121.499 . . 14 11 6 ASN CA C 53.22237 . . 15 12 7 THR H H 8.036 . . 16 12 7 THR CA C 61.98397 . . 17 12 7 THR N N 115.425 . . 18 13 8 SER H H 8.198 . . 19 13 8 SER CA C 58.52877 . . 20 13 8 SER N N 119.233 . . 21 14 9 SER H H 8.165 . . 22 14 9 SER CA C 58.25538 . . 23 14 9 SER N N 118.984 . . 24 15 10 SER H H 8.109 . . 25 15 10 SER CA C 55.64543 . . 26 15 10 SER N N 120.168 . . 27 16 11 PRO CA C 63.47912 . . 28 17 12 GLN H H 7.921 . . 29 17 12 GLN CA C 52.91788 . . 30 17 12 GLN N N 120.482 . . 31 18 13 PRO CA C 62.92472 . . 32 19 14 LYS H H 8.255 . . 33 19 14 LYS CA C 56.20256 . . 34 19 14 LYS N N 123.247 . . 35 20 15 LYS H H 8.152 . . 36 20 15 LYS CA C 56.20201 . . 37 20 15 LYS N N 124.356 . . 38 21 16 LYS H H 8.04 . . 39 21 16 LYS CA C 54.14919 . . 40 21 16 LYS N N 124.178 . . 41 22 17 PRO CA C 63.10479 . . 42 23 18 LEU H H 8.192 . . 43 23 18 LEU CA C 55.26946 . . 44 23 18 LEU N N 123.417 . . 45 24 19 ASP H H 8.154 . . 46 24 19 ASP CA C 54.15028 . . 47 24 19 ASP N N 122.164 . . 48 25 20 GLY H H 8.085 . . 49 25 20 GLY CA C 45.18705 . . 50 25 20 GLY N N 110.402 . . 51 26 21 GLU H H 7.761 . . 52 26 21 GLU CA C 55.91281 . . 53 26 21 GLU N N 121.335 . . 54 27 22 TYR H H 7.763 . . 55 27 22 TYR CA C 57.32719 . . 56 27 22 TYR N N 120.81 . . 57 28 23 PHE H H 9.082 . . 58 28 23 PHE CA C 56.5758 . . 59 28 23 PHE N N 122.392 . . 60 29 24 THR H H 8.25 . . 61 29 24 THR CA C 61.23967 . . 62 29 24 THR N N 115.81 . . 63 30 25 LEU H H 8.739 . . 64 30 25 LEU CA C 53.39943 . . 65 30 25 LEU N N 127.789 . . 66 31 26 GLN H H 8.464 . . 67 31 26 GLN CA C 55.26618 . . 68 31 26 GLN N N 126.414 . . 69 32 27 ILE H H 9.232 . . 70 32 27 ILE CA C 59.56227 . . 71 32 27 ILE N N 127.889 . . 72 33 28 ARG H H 9.461 . . 73 33 28 ARG CA C 55.45772 . . 74 33 28 ARG N N 131.219 . . 75 34 29 GLY H H 8.529 . . 76 34 29 GLY CA C 44.62064 . . 77 34 29 GLY N N 116.132 . . 78 35 30 ARG H H 8.684 . . 79 35 30 ARG CA C 59.56227 . . 80 35 30 ARG N N 127.599 . . 81 36 31 GLU H H 8.597 . . 82 36 31 GLU CA C 59.75053 . . 83 36 31 GLU N N 120.077 . . 84 37 32 ARG H H 8.241 . . 85 37 32 ARG CA C 59.553 . . 86 37 32 ARG N N 121.207 . . 87 38 33 PHE H H 8.241 . . 88 38 33 PHE CA C 61.63393 . . 89 38 33 PHE N N 121.207 . . 90 39 34 GLU H H 8.316 . . 91 39 34 GLU CA C 58.81743 . . 92 39 34 GLU N N 119.391 . . 93 40 35 MET H H 7.465 . . 94 40 35 MET CA C 58.4431 . . 95 40 35 MET N N 121.63 . . 96 41 36 PHE H H 7.898 . . 97 41 36 PHE CA C 61.61128 . . 98 41 36 PHE N N 118.973 . . 99 42 37 ARG H H 9.015 . . 100 42 37 ARG CA C 59.74916 . . 101 42 37 ARG N N 122.421 . . 102 43 38 GLU H H 7.826 . . 103 43 38 GLU CA C 59.31126 . . 104 43 38 GLU N N 124.138 . . 105 44 39 LEU H H 7.71 . . 106 44 39 LEU CA C 58.25593 . . 107 44 39 LEU N N 120.139 . . 108 45 40 ASN H H 8.648 . . 109 45 40 ASN CA C 57.50727 . . 110 45 40 ASN N N 118.782 . . 111 46 41 GLU H H 8.619 . . 112 46 41 GLU CA C 59.00023 . . 113 46 41 GLU N N 118.911 . . 114 47 42 ALA H H 7.821 . . 115 47 42 ALA CA C 55.45717 . . 116 47 42 ALA N N 123.244 . . 117 48 43 LEU H H 8.374 . . 118 48 43 LEU CA C 58.55933 . . 119 48 43 LEU N N 122.261 . . 120 49 44 GLU H H 7.97 . . 121 49 44 GLU CA C 58.62126 . . 122 49 44 GLU N N 124.354 . . 123 50 45 LEU H H 7.925 . . 124 50 45 LEU CA C 57.87887 . . 125 50 45 LEU N N 124.591 . . 126 51 46 LYS H H 7.669 . . 127 51 46 LYS CA C 59.37594 . . 128 51 46 LYS N N 122.423 . . 129 52 47 ASP H H 8.019 . . 130 52 47 ASP CA C 56.94304 . . 131 52 47 ASP N N 121.25 . . 132 53 48 ALA H H 7.55 . . 133 53 48 ALA CA C 53.96693 . . 134 53 48 ALA N N 122.597 . . 135 54 49 GLN H H 7.747 . . 136 54 49 GLN CA C 56.76515 . . 137 54 49 GLN N N 118.492 . . 138 55 50 ALA H H 7.711 . . 139 55 50 ALA CA C 53.21745 . . 140 55 50 ALA N N 123.831 . . 141 56 51 GLY H H 8.008 . . 142 56 51 GLY CA C 45.56602 . . 143 56 51 GLY N N 108.585 . . 144 57 52 LYS H H 7.77 . . 145 57 52 LYS CA C 56.01921 . . 146 57 52 LYS N N 121.798 . . 147 58 53 GLU H H 8.256 . . 148 58 53 GLU CA C 54.33881 . . 149 58 53 GLU N N 126.149 . . 150 59 54 PRO CA C 63.48021 . . 151 60 55 GLY H H 7.918 . . 152 60 55 GLY CA C 45.94007 . . 153 60 55 GLY N N 115.481 . . stop_ save_