==== 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 OXIDOREDUCTASE/DNA 31-DEC-07 3BTX . COMPND 2 MOLECULE: ALPHA-KETOGLUTARATE-DEPENDENT DIOXYGENASE ALKB HO . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.-G.YANG,C.YI,C.HE . 204 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10422.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 32.4 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 . 3 1.5 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 . 25 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 1 1 2 4 2 1 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 1 0 0 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 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 55 A A 0 0 116 0, 0.0 2,-0.6 0, 0.0 15,-0.0 0.000 360.0 360.0 360.0 146.7 122.1 -20.9 -195.9 2 56 A S - 0 0 104 15,-0.1 2,-0.4 2,-0.0 15,-0.3 -0.885 360.0-170.6-103.2 118.9 119.0 -22.1 -194.1 3 57 A W - 0 0 70 -2,-0.6 2,-0.7 13,-0.1 13,-0.2 -0.835 23.6-140.2-108.7 141.0 115.8 -20.2 -195.0 4 58 A R E -A 15 0A 131 11,-2.9 11,-2.7 -2,-0.4 2,-0.5 -0.921 31.0-142.3 -90.9 115.0 112.3 -20.4 -193.5 5 59 A H E -A 14 0A 105 -2,-0.7 2,-0.8 9,-0.2 9,-0.2 -0.706 9.6-157.1 -87.2 127.1 110.1 -20.2 -196.5 6 60 A I E +A 13 0A 10 7,-3.3 7,-2.4 -2,-0.5 2,-0.4 -0.876 26.6 167.3-103.9 100.4 106.9 -18.1 -196.2 7 61 A R E +A 12 0A 164 -2,-0.8 2,-0.3 5,-0.2 5,-0.2 -0.942 9.8 129.9-124.3 139.2 104.4 -19.4 -198.8 8 62 A A E > S-A 11 0A 44 3,-1.7 3,-1.7 -2,-0.4 2,-0.6 -0.877 70.4 -38.2-159.1-172.6 100.7 -18.9 -199.4 9 63 A E T 3 S- 0 0 109 1,-0.3 3,-0.1 -2,-0.3 148,-0.0 -0.448 132.6 -12.7 -64.0 108.7 98.5 -18.0 -202.3 10 64 A G T 3 S+ 0 0 23 -2,-0.6 2,-0.5 1,-0.2 169,-0.4 0.507 113.2 117.8 75.1 5.1 100.5 -15.3 -204.2 11 65 A L E < +A 8 0A 5 -3,-1.7 -3,-1.7 168,-0.1 2,-0.3 -0.927 31.1 164.4-106.3 122.3 102.8 -15.0 -201.2 12 66 A D E +A 7 0A 43 -2,-0.5 161,-2.1 161,-0.5 164,-0.3 -0.841 18.5 137.3-139.7 98.9 106.5 -15.9 -201.7 13 67 A S E -AB 6 172A 0 -7,-2.4 -7,-3.3 -2,-0.3 2,-0.3 -0.933 31.8-152.5-136.5 160.0 108.9 -14.7 -199.0 14 68 A S E -AB 5 171A 11 157,-2.2 157,-3.0 -2,-0.3 2,-0.4 -0.999 5.0-155.5-139.4 144.5 111.9 -16.2 -197.1 15 69 A Y E +AB 4 170A 30 -11,-2.7 -11,-2.9 -2,-0.3 2,-0.3 -0.947 20.1 155.3-122.7 135.6 113.4 -15.5 -193.6 16 70 A T E - B 0 169A 15 153,-2.2 153,-3.4 -2,-0.4 2,-0.6 -0.979 40.0-119.0-150.6 157.8 116.9 -16.0 -192.3 17 71 A V E + B 0 168A 83 -15,-0.3 151,-0.3 -2,-0.3 -15,-0.1 -0.919 27.0 178.6-101.9 118.9 119.2 -14.6 -189.6 18 72 A L + 0 0 33 149,-2.2 2,-0.4 -2,-0.6 150,-0.2 0.831 62.4 37.7 -85.7 -38.2 122.3 -13.0 -191.1 19 73 A F S S- 0 0 9 148,-1.7 -1,-0.2 147,-0.1 2,-0.0 -0.928 71.3-129.8-126.0 140.9 124.1 -11.8 -188.0 20 74 A G > - 0 0 52 -2,-0.4 4,-2.3 -3,-0.1 5,-0.2 -0.236 46.8 -88.9 -73.8 175.4 124.7 -13.1 -184.4 21 75 A K H > S+ 0 0 151 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.893 122.4 50.1 -58.5 -49.0 123.9 -10.8 -181.4 22 76 A A H > S+ 0 0 68 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.902 115.3 42.0 -58.4 -47.3 127.4 -9.1 -181.1 23 77 A E H > S+ 0 0 79 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.892 114.2 51.3 -69.4 -40.1 127.6 -8.2 -184.8 24 78 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.860 108.4 53.5 -65.4 -35.6 124.0 -7.0 -185.0 25 79 A D H X S+ 0 0 43 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.929 109.2 48.0 -61.7 -47.7 124.5 -4.9 -181.9 26 80 A E H X S+ 0 0 115 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.915 113.4 47.5 -59.5 -46.4 127.5 -3.2 -183.6 27 81 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.917 111.9 49.9 -61.3 -46.5 125.6 -2.5 -186.8 28 82 A F H X S+ 0 0 36 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.918 110.8 49.9 -57.1 -47.9 122.6 -1.2 -184.9 29 83 A Q H X S+ 0 0 123 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.899 112.0 47.7 -58.0 -44.6 124.9 1.2 -182.9 30 84 A E H X S+ 0 0 67 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.901 110.9 51.4 -66.4 -40.5 126.5 2.4 -186.1 31 85 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.899 109.9 49.9 -58.7 -43.5 123.1 2.9 -187.7 32 86 A E H < S+ 0 0 65 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.869 115.8 43.5 -63.8 -36.8 121.9 4.9 -184.7 33 87 A K H < S+ 0 0 166 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.866 125.9 28.8 -72.1 -40.1 125.0 7.1 -184.9 34 88 A E H < S+ 0 0 78 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.790 88.4 97.6-102.6 -34.2 125.1 7.6 -188.7 35 89 A V < - 0 0 14 -4,-2.3 2,-0.6 -5,-0.3 24,-0.0 -0.416 55.3-152.8 -68.1 130.5 121.6 7.5 -190.2 36 90 A E - 0 0 128 -2,-0.2 2,-0.3 24,-0.1 24,-0.2 -0.930 13.3-153.8-104.2 118.9 120.0 10.9 -190.8 37 91 A Y - 0 0 40 -2,-0.6 22,-0.2 22,-0.1 6,-0.1 -0.639 19.4-105.3 -95.4 149.0 116.1 10.8 -190.8 38 92 A F - 0 0 22 20,-3.0 20,-0.4 -2,-0.3 2,-0.3 -0.342 39.8-173.1 -64.8 149.4 113.7 13.2 -192.5 39 93 A T > - 0 0 112 18,-0.1 3,-1.9 -2,-0.1 5,-0.2 -0.857 42.2 -0.6-135.6 169.7 111.9 15.8 -190.4 40 94 A G G > S+ 0 0 52 1,-0.3 3,-1.7 -2,-0.3 -2,-0.0 -0.209 129.4 9.6 60.8-124.2 109.1 18.4 -190.8 41 95 A A G > S+ 0 0 86 1,-0.3 3,-0.8 2,-0.2 -1,-0.3 0.749 129.3 58.4 -62.1 -27.1 107.6 18.7 -194.3 42 96 A L G < S+ 0 0 79 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.200 101.8 56.1 -90.3 15.4 109.5 15.5 -195.3 43 97 A A G < S+ 0 0 19 -3,-1.7 11,-2.8 -4,-0.1 2,-0.4 0.085 88.6 93.8-130.2 17.8 107.8 13.5 -192.5 44 98 A R E < -H 53 0B 100 -3,-0.8 2,-0.3 9,-0.2 9,-0.2 -0.952 50.0-173.8-120.6 134.7 104.2 14.2 -193.5 45 99 A V E -H 52 0B 13 7,-2.8 7,-2.7 -2,-0.4 2,-0.5 -0.859 20.0-133.1-124.1 158.8 101.9 12.1 -195.7 46 100 A Q E +H 51 0B 85 25,-2.6 2,-0.4 -2,-0.3 5,-0.2 -0.961 31.5 162.9-114.8 119.6 98.4 12.4 -197.1 47 101 A V E > -H 50 0B 67 3,-2.4 3,-1.8 -2,-0.5 -2,-0.0 -0.999 68.4 -3.5-138.0 134.0 96.0 9.4 -196.8 48 102 A F T 3 S- 0 0 212 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.823 130.8 -55.3 52.5 34.1 92.2 9.4 -197.2 49 103 A G T 3 S+ 0 0 62 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.466 117.6 100.6 83.8 3.2 92.3 13.2 -197.7 50 104 A K E < -H 47 0B 149 -3,-1.8 -3,-2.4 2,-0.0 2,-0.3 -0.967 65.0-131.0-126.5 140.3 94.1 14.1 -194.4 51 105 A W E +H 46 0B 122 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.661 29.2 175.9 -88.4 139.2 97.7 15.0 -193.7 52 106 A H E -H 45 0B 97 -7,-2.7 -7,-2.8 -2,-0.3 2,-0.4 -0.989 35.0-117.6-139.5 146.8 99.6 13.2 -190.9 53 107 A S E -H 44 0B 72 -2,-0.3 -9,-0.2 -9,-0.2 -12,-0.1 -0.710 51.0-102.6 -75.1 134.3 103.1 13.2 -189.4 54 108 A V - 0 0 15 -11,-2.8 2,-1.8 -2,-0.4 -1,-0.1 -0.377 23.1-126.3 -63.6 137.2 104.4 9.6 -189.9 55 109 A P S S+ 0 0 46 0, 0.0 58,-2.0 0, 0.0 2,-0.3 -0.342 90.4 25.6 -82.6 56.7 104.3 7.5 -186.6 56 110 A R S S- 0 0 30 -2,-1.8 2,-0.4 56,-0.2 51,-0.2 -0.913 95.4 -83.7 176.4-171.7 108.0 6.6 -186.9 57 111 A K E -C 106 0A 113 49,-2.2 49,-3.0 -2,-0.3 2,-0.3 -0.966 38.7-162.2-120.9 145.1 111.1 8.1 -188.6 58 112 A Q E +C 105 0A 4 -20,-0.4 -20,-3.0 -2,-0.4 2,-0.3 -0.958 11.4 175.8-129.3 145.7 112.1 7.6 -192.2 59 113 A A E -C 104 0A 0 45,-2.1 45,-3.2 -2,-0.3 2,-0.4 -0.984 12.7-154.5-141.8 147.3 115.3 7.9 -194.3 60 114 A T E +C 103 0A 0 -2,-0.3 18,-2.8 16,-0.3 2,-0.3 -0.997 15.6 171.1-127.0 132.6 116.2 7.2 -197.9 61 115 A Y E +Cd 102 78A 5 41,-2.3 41,-3.1 -2,-0.4 2,-0.3 -0.928 22.5 100.6-129.9 155.5 119.6 6.4 -199.3 62 116 A G E -C 101 0A 3 16,-2.1 39,-0.2 -2,-0.3 18,-0.2 -0.954 64.2 -23.6 158.9-173.6 120.7 5.2 -202.7 63 117 A D S > S- 0 0 73 37,-2.3 3,-0.9 -2,-0.3 37,-0.1 -0.171 75.3 -85.7 -63.0 155.0 122.2 6.1 -206.1 64 118 A A T 3 S+ 0 0 95 1,-0.2 -1,-0.1 12,-0.1 3,-0.1 -0.275 104.7 22.3 -66.1 144.0 121.9 9.6 -207.5 65 119 A G T 3 S+ 0 0 62 1,-0.3 -1,-0.2 12,-0.2 -2,-0.1 0.042 88.2 121.7 95.8 -25.4 118.9 10.9 -209.4 66 120 A L < - 0 0 6 -3,-0.9 2,-0.3 34,-0.1 -1,-0.3 -0.278 42.3-162.1 -68.9 153.2 116.4 8.4 -208.1 67 121 A T - 0 0 57 136,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.949 9.8-151.4-132.5 160.5 113.2 9.4 -206.2 68 122 A Y E -I 75 0C 10 7,-1.9 7,-3.3 -2,-0.3 2,-0.4 -0.979 17.9-178.1-134.9 116.7 110.8 7.6 -204.0 69 123 A T E +I 74 0C 57 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.966 13.1 145.2-123.8 130.7 107.1 8.8 -203.8 70 124 A F E > +I 73 0C 51 3,-2.4 3,-2.3 -2,-0.4 -24,-0.1 -0.955 65.2 4.9-155.9 148.1 104.2 7.5 -201.7 71 125 A S T 3 S- 0 0 53 -2,-0.3 -25,-2.6 1,-0.3 3,-0.1 0.850 129.6 -51.9 49.2 46.9 101.2 9.0 -200.0 72 126 A G T 3 S+ 0 0 54 -27,-0.2 2,-0.5 1,-0.2 -1,-0.3 0.508 116.4 112.2 71.4 6.6 101.7 12.5 -201.4 73 127 A L E < -I 70 0C 9 -3,-2.3 -3,-2.4 -27,-0.1 2,-0.5 -0.951 49.7-161.7-116.5 128.6 105.3 12.6 -200.2 74 128 A T E -I 69 0C 68 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.936 8.8-165.4-107.7 127.0 108.5 12.5 -202.4 75 129 A L E -I 68 0C 0 -7,-3.3 -7,-1.9 -2,-0.5 -16,-0.0 -0.931 8.4-149.7-112.7 130.5 111.8 11.5 -200.8 76 130 A S - 0 0 77 -2,-0.4 -16,-0.3 -9,-0.2 2,-0.2 -0.857 27.0-116.0 -98.4 134.6 115.2 12.1 -202.4 77 131 A P - 0 0 24 0, 0.0 -16,-0.3 0, 0.0 -12,-0.2 -0.467 19.6-135.3 -75.6 138.2 117.9 9.6 -201.5 78 132 A K B -d 61 0A 52 -18,-2.8 -16,-2.1 -2,-0.2 3,-0.1 -0.562 39.8 -85.5 -80.0 151.2 121.1 10.6 -199.6 79 133 A P - 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -16,-0.1 -0.260 57.7 -87.2 -56.0 145.9 124.5 9.3 -200.8 80 134 A W - 0 0 36 -18,-0.2 3,-0.0 -3,-0.1 21,-0.0 -0.207 41.3-155.8 -53.6 138.7 125.5 5.9 -199.6 81 135 A I >> - 0 0 39 -3,-0.1 4,-2.2 1,-0.1 3,-0.9 -0.881 30.1-104.4-116.0 152.6 127.3 5.7 -196.3 82 136 A P H 3> S+ 0 0 96 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.809 116.8 53.2 -46.0 -45.3 129.7 2.8 -195.2 83 137 A V H 3> S+ 0 0 2 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.902 113.5 44.0 -61.2 -38.1 127.3 1.1 -192.8 84 138 A L H <> S+ 0 0 0 -3,-0.9 4,-2.7 2,-0.2 -1,-0.2 0.864 112.4 51.3 -74.4 -38.2 124.6 0.9 -195.5 85 139 A E H X S+ 0 0 71 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.901 107.4 55.7 -62.4 -41.8 127.0 -0.2 -198.2 86 140 A R H X S+ 0 0 93 -4,-2.8 4,-1.9 -5,-0.2 -2,-0.2 0.929 113.2 39.5 -52.1 -53.4 128.2 -3.0 -195.8 87 141 A I H X S+ 0 0 0 -4,-1.7 4,-2.8 2,-0.2 5,-0.2 0.938 114.6 52.7 -67.7 -48.8 124.7 -4.4 -195.3 88 142 A R H X S+ 0 0 40 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.927 112.2 46.2 -48.3 -51.8 123.7 -3.9 -199.0 89 143 A D H X S+ 0 0 89 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.852 111.7 50.7 -65.3 -38.5 126.8 -5.8 -200.1 90 144 A H H X S+ 0 0 77 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.945 111.7 47.4 -63.9 -49.1 126.3 -8.6 -197.6 91 145 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 6,-0.4 0.910 110.8 52.9 -57.2 -45.7 122.7 -9.1 -198.7 92 146 A S H X S+ 0 0 27 -4,-2.5 4,-2.5 -5,-0.2 5,-0.2 0.891 110.3 47.2 -55.0 -44.6 123.7 -9.1 -202.3 93 147 A G H < S+ 0 0 71 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.809 115.5 45.5 -69.6 -31.3 126.3 -11.8 -201.7 94 148 A V H < S+ 0 0 57 -4,-1.8 -2,-0.2 -5,-0.1 -1,-0.2 0.830 126.4 27.5 -79.6 -35.0 123.8 -13.9 -199.7 95 149 A T H < S- 0 0 33 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.703 93.5-126.8-103.0 -25.8 120.9 -13.6 -202.2 96 150 A G S < S+ 0 0 65 -4,-2.5 2,-0.3 1,-0.3 -4,-0.1 0.516 71.9 119.3 84.6 8.0 122.5 -13.0 -205.6 97 151 A Q - 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