==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 02-DEC-05 2F8M . COMPND 2 MOLECULE: RIBOSE 5-PHOSPHATE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR M.A.HOLMES,E.A.MERRITT,STRUCTURAL GENOMICS OF PATHOGENIC PRO . 472 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19675.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 324 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 13.1 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 . 6 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 34 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.1 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 0 0 0 1 5 2 0 0 2 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 4 2 2 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 . 0 6 2 2 4 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 . 2 0 4 0 0 2 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 -3 A H > 0 0 86 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 100.5 53.5 114.5 31.9 2 -2 A H H > + 0 0 124 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.900 360.0 41.3 -78.1 -44.0 54.4 111.0 33.2 3 -1 A H H > S+ 0 0 139 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.777 116.0 55.2 -65.6 -30.7 56.4 111.8 36.4 4 0 A H H > S+ 0 0 77 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.916 107.4 46.6 -67.0 -48.5 53.9 114.5 37.0 5 1 A M H X S+ 0 0 42 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.885 111.2 53.4 -61.3 -39.5 50.9 112.0 36.9 6 2 A D H X S+ 0 0 45 -4,-2.2 4,-3.1 2,-0.2 -2,-0.2 0.956 108.9 48.7 -58.9 -52.8 52.9 109.7 39.1 7 3 A S H X S+ 0 0 64 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.879 110.6 50.7 -53.2 -46.1 53.4 112.5 41.7 8 4 A L H X S+ 0 0 6 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.881 112.3 47.0 -60.3 -42.0 49.7 113.4 41.5 9 5 A K H X S+ 0 0 34 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.939 112.0 51.5 -60.9 -48.7 48.8 109.7 42.1 10 6 A K H X S+ 0 0 91 -4,-3.1 4,-3.3 1,-0.2 5,-0.3 0.920 105.5 55.8 -53.2 -49.1 51.4 109.5 44.9 11 7 A I H X S+ 0 0 70 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.869 110.8 41.3 -55.3 -46.2 49.9 112.5 46.6 12 8 A V H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.859 115.9 51.7 -73.7 -35.0 46.3 111.2 46.9 13 9 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.932 110.2 46.1 -66.8 -52.3 47.5 107.8 47.9 14 10 A Y H X S+ 0 0 42 -4,-3.3 4,-3.0 1,-0.2 5,-0.3 0.911 112.3 54.1 -56.9 -40.8 49.8 109.0 50.7 15 11 A K H X S+ 0 0 37 -4,-1.8 4,-2.5 -5,-0.3 5,-0.4 0.922 105.2 51.2 -62.8 -41.6 47.0 111.2 51.9 16 12 A A H X>S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 5,-0.7 0.929 116.3 42.1 -62.6 -41.1 44.5 108.4 52.1 17 13 A V H X5S+ 0 0 1 -4,-1.9 4,-1.7 3,-0.2 -2,-0.2 0.982 116.9 45.8 -69.8 -54.2 46.9 106.3 54.2 18 14 A D H <5S+ 0 0 79 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.865 122.7 34.3 -57.9 -38.6 48.2 109.2 56.4 19 15 A E H <5S+ 0 0 120 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.747 131.3 21.3 -95.0 -21.5 44.8 110.6 57.2 20 16 A Y H <5S+ 0 0 49 -4,-1.7 2,-0.4 -5,-0.4 -3,-0.2 0.702 96.5 87.3-121.1 -28.2 42.5 107.6 57.3 21 17 A V << + 0 0 10 -4,-1.7 2,-0.3 -5,-0.7 -1,-0.0 -0.682 54.1 179.7 -88.0 131.9 44.4 104.4 58.0 22 18 A Q > - 0 0 123 -2,-0.4 3,-0.8 1,-0.1 29,-0.1 -0.773 33.5 -84.9-126.5 162.2 45.1 103.5 61.6 23 19 A S T 3 S+ 0 0 45 -2,-0.3 30,-0.2 1,-0.2 31,-0.1 -0.300 110.2 27.8 -65.2 154.5 46.8 100.8 63.6 24 20 A N T 3 S+ 0 0 113 28,-2.2 2,-0.3 1,-0.3 -1,-0.2 0.803 95.2 130.3 61.6 30.4 44.8 97.6 64.4 25 21 A M < - 0 0 29 -3,-0.8 30,-1.6 27,-0.3 2,-0.5 -0.822 57.6-133.5-106.7 151.4 42.7 98.1 61.2 26 22 A T E -a 55 0A 33 -2,-0.3 58,-2.1 56,-0.2 59,-1.2 -0.938 30.3-162.4 -97.6 133.1 41.8 95.7 58.5 27 23 A I E -ab 56 85A 0 28,-2.4 30,-2.5 -2,-0.5 2,-0.5 -0.941 15.8-144.2-127.6 127.0 42.3 97.4 55.1 28 24 A G E -ab 57 86A 0 57,-2.8 59,-2.4 -2,-0.4 2,-0.5 -0.799 21.2-148.9 -89.8 133.2 40.9 96.5 51.7 29 25 A L E -ab 58 87A 0 28,-2.7 30,-1.5 -2,-0.5 59,-0.2 -0.887 7.4-150.7-111.4 122.6 43.4 97.3 49.0 30 26 A G - 0 0 0 57,-2.8 29,-0.4 -2,-0.5 2,-0.3 0.274 20.9-101.3 -71.6-154.9 42.3 98.3 45.5 31 27 A T + 0 0 22 28,-0.1 58,-0.5 27,-0.1 4,-0.3 -0.958 60.5 37.4-138.9 144.3 44.1 97.8 42.2 32 28 A G S > S- 0 0 32 -2,-0.3 4,-1.1 1,-0.2 -2,-0.0 -0.509 90.1 -46.6 113.3-169.9 46.2 99.8 39.7 33 29 A S T 4 S+ 0 0 64 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.770 127.6 50.1 -81.5 -30.0 48.8 102.4 39.4 34 30 A T T >4 S+ 0 0 7 -3,-0.2 3,-1.5 1,-0.2 4,-0.5 0.922 109.7 51.7 -66.3 -45.8 47.4 104.9 41.8 35 31 A V T >> S+ 0 0 2 1,-0.3 4,-1.9 -4,-0.3 3,-1.0 0.718 89.2 81.0 -67.5 -25.0 47.0 102.2 44.5 36 32 A F H 3X S+ 0 0 88 -4,-1.1 4,-2.0 1,-0.2 -1,-0.3 0.832 92.1 50.3 -41.2 -40.1 50.6 101.2 44.1 37 33 A Y H <> S+ 0 0 32 -3,-1.5 4,-1.9 -4,-0.3 -1,-0.2 0.679 102.7 59.7 -85.3 -21.9 51.5 104.2 46.3 38 34 A V H <> S+ 0 0 0 -3,-1.0 4,-2.5 -4,-0.5 -1,-0.2 0.867 107.9 45.4 -63.3 -46.2 49.0 103.1 48.9 39 35 A L H X S+ 0 0 5 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.928 113.0 52.2 -62.7 -43.5 51.0 99.8 49.2 40 36 A E H X S+ 0 0 63 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.919 113.3 42.8 -57.6 -46.4 54.2 101.7 49.2 41 37 A R H X S+ 0 0 56 -4,-1.9 4,-2.9 2,-0.2 5,-0.3 0.922 111.8 51.1 -72.9 -42.7 53.1 103.9 52.0 42 38 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.945 113.6 45.9 -62.3 -47.9 51.5 101.3 54.2 43 39 A D H X S+ 0 0 22 -4,-2.4 4,-2.6 -5,-0.2 5,-0.2 0.938 112.1 52.8 -56.0 -50.3 54.7 99.2 54.0 44 40 A N H X S+ 0 0 76 -4,-2.4 4,-1.9 -5,-0.3 6,-0.2 0.953 113.7 41.6 -46.9 -54.7 56.8 102.3 54.7 45 41 A L H X>S+ 0 0 21 -4,-2.9 6,-2.3 1,-0.2 5,-0.9 0.783 113.2 53.6 -71.6 -27.8 54.7 103.1 57.9 46 42 A L H <5S+ 0 0 37 -4,-1.9 3,-0.4 -5,-0.3 -1,-0.2 0.889 109.3 47.9 -72.5 -42.0 54.6 99.5 59.0 47 43 A K H <5S+ 0 0 141 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.857 112.9 49.2 -67.7 -34.4 58.3 99.1 58.8 48 44 A S H <5S- 0 0 82 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.631 110.5-121.5 -77.6 -16.4 58.8 102.4 60.7 49 45 A G T <5S+ 0 0 55 -4,-0.7 -3,-0.2 -3,-0.4 -4,-0.1 0.414 83.3 118.9 87.4 -1.9 56.4 101.4 63.4 50 46 A K S S- 0 0 8 -30,-0.2 4,-1.9 -31,-0.1 5,-0.1 -0.968 77.0-112.5-153.3 169.4 43.2 91.2 42.8 61 57 A I H > S+ 0 0 68 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.884 118.2 57.4 -71.6 -37.1 45.9 88.7 42.4 62 58 A D H > S+ 0 0 69 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.920 109.3 44.9 -53.6 -46.5 48.2 91.5 41.1 63 59 A T H > S+ 0 0 3 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.885 111.1 53.0 -70.9 -39.2 47.6 93.4 44.3 64 60 A E H X S+ 0 0 62 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.919 110.7 46.8 -60.0 -46.2 48.1 90.3 46.5 65 61 A L H X S+ 0 0 113 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.921 112.9 48.9 -60.6 -49.8 51.5 89.6 44.8 66 62 A K H X S+ 0 0 80 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.859 113.6 47.6 -57.6 -38.3 52.7 93.2 45.1 67 63 A A H X>S+ 0 0 0 -4,-1.9 5,-2.1 1,-0.2 4,-1.2 0.836 110.0 51.3 -77.0 -31.9 51.7 93.3 48.8 68 64 A R H <5S+ 0 0 143 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.876 107.9 51.5 -73.9 -41.5 53.3 90.0 49.6 69 65 A K H <5S+ 0 0 93 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.916 110.9 49.6 -54.4 -49.2 56.7 91.1 48.0 70 66 A L H <5S- 0 0 57 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.815 115.8-120.0 -61.0 -30.2 56.5 94.3 50.1 71 67 A G T <5 + 0 0 51 -4,-1.2 -3,-0.2 1,-0.3 -2,-0.1 0.608 55.5 156.3 94.2 16.6 55.8 92.2 53.2 72 68 A I < - 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