==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/ANTAGONIST 12-FEB-13 4J74 . COMPND 2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE MDM2; . SOURCE 2 ORGANISM_SCIENTIFIC: XENOPUS LAEVIS; . AUTHOR C.JANSON,C.LUKACS,U.KAMMLOTT,B.GRAVES . 86 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6031.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 58 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 11.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 4 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 33.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 0 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 20 A M 0 0 233 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 142.3 8.1 -11.5 -8.1 2 21 A E - 0 0 126 1,-0.1 2,-0.2 24,-0.0 24,-0.0 -0.408 360.0-103.8 -68.2 142.7 4.4 -12.4 -7.4 3 22 A K - 0 0 160 -2,-0.1 24,-0.4 1,-0.0 2,-0.4 -0.473 32.2-141.7 -71.1 133.8 2.6 -14.1 -10.2 4 23 A L - 0 0 96 -2,-0.2 2,-0.3 22,-0.1 22,-0.2 -0.774 12.5-154.0 -97.3 141.1 0.2 -11.8 -12.1 5 24 A V B -A 25 0A 23 20,-3.5 20,-2.1 -2,-0.4 81,-0.1 -0.762 8.2-136.1-114.1 161.5 -3.2 -13.1 -13.4 6 25 A Q - 0 0 101 79,-0.3 79,-2.9 -2,-0.3 18,-0.2 -0.908 15.3-141.4-125.7 101.7 -5.3 -11.9 -16.3 7 26 A P B -B 84 0B 6 0, 0.0 77,-0.3 0, 0.0 74,-0.1 -0.334 20.3-123.5 -60.1 138.7 -9.1 -11.5 -15.8 8 27 A T > - 0 0 40 75,-2.0 4,-2.7 1,-0.0 5,-0.3 -0.247 44.8 -79.7 -74.2 172.5 -11.2 -12.5 -18.8 9 28 A P H > S+ 0 0 107 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.797 124.4 44.8 -53.7 -43.5 -13.6 -9.9 -20.1 10 29 A L H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.954 117.7 43.0 -69.4 -48.5 -16.5 -10.0 -17.7 11 30 A L H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.913 113.5 53.7 -61.1 -40.3 -14.4 -10.0 -14.5 12 31 A L H X S+ 0 0 32 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.913 107.3 51.3 -61.0 -40.8 -12.2 -7.4 -16.0 13 32 A S H X S+ 0 0 77 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.903 111.1 47.7 -62.6 -42.2 -15.2 -5.2 -16.7 14 33 A L H X S+ 0 0 15 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.935 111.1 51.1 -62.5 -46.4 -16.4 -5.6 -13.1 15 34 A L H <>S+ 0 0 0 -4,-2.8 5,-2.4 1,-0.2 3,-0.4 0.901 111.8 46.3 -60.3 -42.0 -12.9 -4.8 -11.7 16 35 A K H ><5S+ 0 0 87 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.829 106.4 58.0 -72.2 -30.8 -12.6 -1.6 -13.7 17 36 A S H 3<5S+ 0 0 84 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.752 105.8 52.9 -66.5 -22.1 -16.1 -0.6 -12.7 18 37 A A T 3<5S- 0 0 34 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.422 136.0 -87.6 -93.2 -1.3 -14.8 -0.8 -9.2 19 38 A G T < 5S+ 0 0 44 -3,-1.2 -3,-0.2 1,-0.3 -2,-0.1 0.378 76.4 146.5 115.5 -3.7 -11.8 1.4 -10.0 20 39 A A < - 0 0 7 -5,-2.4 -1,-0.3 -6,-0.2 -2,-0.0 -0.371 24.9-171.6 -65.1 144.7 -9.2 -0.9 -11.4 21 40 A Q + 0 0 179 -2,-0.1 2,-0.2 -6,-0.0 -1,-0.1 0.101 55.2 58.9-131.2 21.1 -7.0 0.6 -14.1 22 41 A K S S- 0 0 85 -10,-0.1 3,-0.1 1,-0.0 -2,-0.0 -0.829 70.0-126.1-140.3-178.2 -4.9 -2.2 -15.5 23 42 A E S S+ 0 0 98 -2,-0.2 2,-0.3 1,-0.1 -1,-0.0 0.595 88.4 48.3-110.0 -17.4 -5.3 -5.6 -17.1 24 43 A T + 0 0 58 -18,-0.2 2,-0.3 -20,-0.0 -18,-0.2 -0.948 63.8 171.9-128.4 153.1 -3.2 -7.9 -14.9 25 44 A F B -A 5 0A 0 -20,-2.1 -20,-3.5 -2,-0.3 2,-0.2 -0.962 36.0-106.0-150.8 154.9 -3.2 -8.2 -11.1 26 45 A T > - 0 0 27 -2,-0.3 4,-2.2 -22,-0.2 5,-0.2 -0.535 44.2-110.5 -75.6 160.6 -1.9 -10.2 -8.2 27 46 A M H > S+ 0 0 22 -24,-0.4 4,-2.6 1,-0.2 5,-0.2 0.890 121.5 58.6 -59.7 -35.9 -4.6 -12.4 -6.6 28 47 A K H > S+ 0 0 173 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.903 106.8 47.3 -59.6 -40.9 -4.5 -10.1 -3.6 29 48 A E H > S+ 0 0 61 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.896 110.0 51.2 -67.9 -41.4 -5.4 -7.1 -5.9 30 49 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.940 112.3 47.5 -60.8 -45.1 -8.2 -9.0 -7.6 31 50 A L H X S+ 0 0 53 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.881 109.0 54.9 -63.7 -38.1 -9.7 -9.9 -4.2 32 51 A Y H X S+ 0 0 136 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.963 110.4 43.9 -60.5 -52.4 -9.3 -6.3 -3.1 33 52 A H H X S+ 0 0 33 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.878 112.3 52.8 -63.6 -37.5 -11.3 -4.9 -5.9 34 53 A L H X S+ 0 0 6 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.907 108.2 51.6 -62.7 -39.9 -14.0 -7.6 -5.7 35 54 A G H X S+ 0 0 22 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.872 108.5 51.2 -62.9 -36.2 -14.3 -6.8 -2.0 36 55 A Q H X S+ 0 0 73 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.917 110.5 48.9 -66.3 -42.7 -14.8 -3.1 -2.9 37 56 A Y H X S+ 0 0 20 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.929 111.5 48.5 -61.3 -46.7 -17.5 -4.0 -5.4 38 57 A I H <>S+ 0 0 10 -4,-2.5 5,-2.3 1,-0.2 4,-0.4 0.914 114.9 45.7 -62.8 -43.2 -19.3 -6.3 -2.9 39 58 A M H ><5S+ 0 0 114 -4,-2.2 3,-1.0 3,-0.2 -2,-0.2 0.930 112.8 49.5 -61.8 -48.3 -19.2 -3.5 -0.3 40 59 A A H 3<5S+ 0 0 81 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.849 112.5 47.1 -63.4 -36.5 -20.3 -0.8 -2.7 41 60 A K T 3<5S- 0 0 114 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.480 107.8-127.4 -84.8 -4.1 -23.2 -2.8 -3.9 42 61 A Q T < 5 + 0 0 160 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.906 54.6 152.6 62.5 44.5 -24.2 -3.7 -0.3 43 62 A L < + 0 0 19 -5,-2.3 10,-3.3 -6,-0.1 -4,-0.1 0.582 31.2 108.3 -87.1 -9.4 -24.3 -7.4 -1.1 44 63 A Y B S-C 52 0C 83 -6,-0.4 8,-0.2 8,-0.2 5,-0.1 -0.426 78.6-109.3 -68.2 140.8 -23.5 -8.5 2.5 45 64 A D - 0 0 45 6,-2.7 6,-0.1 3,-0.5 -1,-0.1 -0.445 24.4-132.3 -64.3 142.0 -26.3 -10.1 4.5 46 65 A E S S+ 0 0 160 1,-0.2 3,-0.2 -2,-0.1 -1,-0.1 0.829 99.6 24.4 -72.0 -31.4 -27.4 -7.8 7.2 47 66 A K S S+ 0 0 179 1,-0.2 2,-0.7 2,-0.0 -1,-0.2 0.759 126.1 45.6-105.3 -33.7 -27.4 -10.4 10.1 48 67 A Q S > S- 0 0 107 1,-0.1 3,-2.4 3,-0.1 -3,-0.5 -0.776 70.8-177.3-108.9 85.3 -24.9 -13.0 8.8 49 68 A Q T 3 S+ 0 0 143 -2,-0.7 -1,-0.1 1,-0.3 21,-0.1 0.522 73.7 67.6 -73.1 -3.7 -22.2 -10.7 7.6 50 69 A H T 3 S+ 0 0 58 -6,-0.1 20,-3.0 19,-0.1 2,-0.4 0.595 86.8 90.0 -80.9 -12.0 -20.0 -13.5 6.2 51 70 A I E < - D 0 69C 39 -3,-2.4 -6,-2.7 18,-0.2 2,-0.5 -0.734 61.4-159.8 -95.2 130.8 -22.6 -14.1 3.6 52 71 A V E -CD 44 68C 0 16,-3.1 16,-1.6 -2,-0.4 2,-0.5 -0.941 12.5-143.8-107.9 121.6 -22.6 -12.4 0.2 53 72 A H E + D 0 67C 65 -10,-3.3 14,-0.2 -2,-0.5 6,-0.1 -0.754 29.4 162.0 -87.9 122.7 -25.9 -12.3 -1.7 54 73 A C > + 0 0 1 12,-3.0 3,-1.4 -2,-0.5 6,-0.7 0.405 47.8 97.5-116.3 -2.5 -25.5 -12.6 -5.5 55 74 A S T 3 S+ 0 0 65 11,-0.9 -1,-0.1 1,-0.3 12,-0.1 0.618 94.2 35.7 -70.9 -14.0 -29.0 -13.6 -6.5 56 75 A N T 3 S+ 0 0 157 10,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.307 111.8 73.3-113.8 4.9 -30.0 -10.0 -7.5 57 76 A D S X S- 0 0 18 -3,-1.4 3,-2.2 1,-0.1 4,-0.5 -0.891 83.2-119.8-127.7 148.3 -26.6 -9.0 -8.9 58 77 A P T >> S+ 0 0 89 0, 0.0 4,-2.0 0, 0.0 3,-0.5 0.741 106.6 77.5 -56.8 -20.9 -24.5 -9.7 -12.0 59 78 A L H 3> S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.831 84.5 65.1 -57.1 -30.3 -21.9 -11.1 -9.7 60 79 A G H <>>S+ 0 0 8 -3,-2.2 4,-2.0 -6,-0.7 5,-1.2 0.920 105.3 40.6 -58.8 -46.0 -24.1 -14.2 -9.4 61 80 A E H <45S+ 0 0 151 -3,-0.5 -1,-0.2 -4,-0.5 -2,-0.2 0.883 113.8 54.9 -68.5 -38.7 -23.6 -15.0 -13.1 62 81 A L H <5S+ 0 0 11 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.920 121.2 28.7 -61.5 -44.7 -19.9 -14.2 -12.9 63 82 A F H <5S- 0 0 3 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.679 103.8-126.3 -89.9 -21.2 -19.3 -16.6 -10.1 64 83 A G T <5S+ 0 0 61 -4,-2.0 2,-0.3 -5,-0.3 -3,-0.2 0.799 72.4 100.3 78.8 29.5 -22.0 -19.0 -10.9 65 84 A V < - 0 0 28 -5,-1.2 -1,-0.3 -6,-0.3 -2,-0.2 -0.939 64.5-144.1-141.2 164.0 -23.6 -19.0 -7.4 66 85 A Q S S+ 0 0 137 1,-0.4 -12,-3.0 -2,-0.3 -11,-0.9 0.814 89.7 2.0 -95.9 -41.0 -26.6 -17.4 -5.6 67 86 A E E -D 53 0C 78 -14,-0.2 -1,-0.4 -13,-0.2 2,-0.3 -0.976 65.1-179.3-136.1 154.6 -24.8 -16.9 -2.2 68 87 A F E -D 52 0C 6 -16,-1.6 -16,-3.1 -2,-0.3 2,-0.4 -0.976 24.9-120.8-144.7 163.5 -21.3 -17.6 -1.0 69 88 A S E > -D 51 0C 14 -2,-0.3 3,-1.6 -18,-0.2 -18,-0.2 -0.860 10.7-141.4-102.5 135.9 -19.5 -17.1 2.3 70 89 A V T 3 S+ 0 0 45 -20,-3.0 -19,-0.1 -2,-0.4 -1,-0.1 0.607 102.6 65.2 -67.2 -10.0 -16.4 -14.9 2.6 71 90 A K T 3 S+ 0 0 157 -21,-0.3 2,-1.2 1,-0.2 -1,-0.3 0.551 80.8 80.5 -90.1 -8.8 -15.0 -17.6 4.9 72 91 A E <> + 0 0 99 -3,-1.6 4,-1.7 1,-0.2 -1,-0.2 -0.675 56.9 166.8 -98.1 81.3 -14.9 -20.3 2.1 73 92 A H H > + 0 0 122 -2,-1.2 4,-2.5 1,-0.2 5,-0.2 0.847 69.1 53.7 -71.3 -37.8 -11.6 -19.1 0.6 74 93 A R H > S+ 0 0 226 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.921 109.8 51.0 -62.6 -40.4 -10.8 -22.1 -1.6 75 94 A R H > S+ 0 0 86 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.900 109.7 49.4 -62.3 -41.9 -14.3 -21.7 -3.2 76 95 A I H X S+ 0 0 19 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.916 109.2 51.2 -65.7 -43.1 -13.7 -18.0 -3.8 77 96 A Y H X S+ 0 0 103 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.910 110.4 50.8 -58.2 -41.1 -10.4 -18.7 -5.5 78 97 A A H X S+ 0 0 44 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.893 108.5 50.4 -64.8 -40.8 -12.0 -21.3 -7.7 79 98 A M H < S+ 0 0 2 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.865 113.9 45.9 -67.5 -34.7 -14.8 -18.9 -8.8 80 99 A I H >< S+ 0 0 0 -4,-2.1 3,-2.2 1,-0.2 -2,-0.2 0.907 106.8 57.8 -70.7 -43.0 -12.2 -16.3 -9.7 81 100 A S H >< S+ 0 0 62 -4,-2.7 3,-1.9 1,-0.3 -2,-0.2 0.849 95.8 62.5 -60.1 -34.2 -10.0 -18.8 -11.5 82 101 A R T 3< S+ 0 0 147 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.670 106.1 50.3 -63.7 -12.4 -12.8 -19.7 -13.9 83 102 A N T < S+ 0 0 22 -3,-2.2 -75,-2.0 -4,-0.2 2,-0.4 -0.059 95.8 87.7-116.6 29.5 -12.6 -16.0 -14.9 84 103 A L B < S-B 7 0B 23 -3,-1.9 2,-0.2 -77,-0.3 -79,-0.0 -0.956 84.0-103.1-123.7 147.5 -8.8 -15.8 -15.5 85 104 A V 0 0 70 -79,-2.9 -79,-0.3 -2,-0.4 -2,-0.1 -0.499 360.0 360.0 -67.3 131.9 -6.9 -16.6 -18.7 86 105 A S 0 0 180 -2,-0.2 -1,-0.2 -81,-0.1 -5,-0.0 0.868 360.0 360.0 -92.9 360.0 -5.1 -19.9 -18.7