==== 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 17-AUG-03 1Q7C . COMPND 2 MOLECULE: 3-OXOACYL-[ACYL-CARRIER PROTEIN] REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.C.PRICE,Y.-M.ZHANG,C.O.ROCK,S.M.WHITE . 486 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20446.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 77.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 31 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 191 39.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.9 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 2 2 0 0 2 0 0 4 4 0 2 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 6 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 2 A N 0 0 134 0, 0.0 27,-0.2 0, 0.0 223,-0.2 0.000 360.0 360.0 360.0 112.3 -30.3 8.7 42.6 2 3 A F > + 0 0 9 25,-2.1 3,-3.3 22,-0.3 28,-0.2 -0.236 360.0 178.9-102.3 43.2 -28.9 7.1 45.7 3 4 A E T 3 S+ 0 0 142 1,-0.3 26,-0.2 24,-0.2 3,-0.1 -0.226 76.3 3.4 -48.4 114.3 -32.1 5.7 47.2 4 5 A G T 3 S+ 0 0 59 24,-0.9 2,-0.3 1,-0.3 -1,-0.3 0.540 100.6 131.1 85.6 4.9 -31.0 3.9 50.3 5 6 A K < - 0 0 48 -3,-3.3 25,-2.4 23,-0.2 2,-0.5 -0.699 47.7-145.0 -93.6 145.3 -27.4 4.9 50.1 6 7 A I E -a 30 0A 15 -2,-0.3 75,-2.6 72,-0.2 74,-2.4 -0.945 17.2-171.2-112.5 125.8 -25.5 6.3 53.0 7 8 A A E -ab 31 81A 0 23,-2.1 25,-2.7 -2,-0.5 2,-0.6 -0.946 13.1-158.2-121.2 138.7 -22.9 9.0 52.4 8 9 A L E -ab 32 82A 1 73,-2.9 75,-2.8 -2,-0.4 2,-0.7 -0.961 10.2-171.3-114.3 115.4 -20.4 10.5 54.8 9 10 A V E > -ab 33 83A 0 23,-2.2 25,-1.7 -2,-0.6 3,-0.6 -0.895 12.3-149.3-112.4 104.1 -19.1 13.9 53.6 10 11 A T T 3 S+ 0 0 2 73,-1.8 75,-0.5 -2,-0.7 25,-0.1 -0.469 78.7 15.7 -72.3 137.9 -16.2 15.2 55.8 11 12 A G T 3 S+ 0 0 24 -2,-0.2 3,-0.4 74,-0.1 6,-0.2 0.927 74.8 155.6 66.8 48.3 -15.9 19.0 56.1 12 13 A A < + 0 0 0 22,-1.5 23,-0.1 -3,-0.6 -1,-0.1 0.044 31.1 110.8 -95.9 26.6 -19.4 19.8 54.9 13 14 A S S S- 0 0 35 21,-0.4 2,-0.2 1,-0.1 -1,-0.2 0.861 86.4 -23.9 -67.7 -37.9 -19.9 23.2 56.6 14 15 A R S > S+ 0 0 160 -3,-0.4 4,-2.2 4,-0.0 3,-0.5 -0.864 103.2 17.3-156.9-169.7 -19.8 25.3 53.4 15 16 A G H > S- 0 0 33 -2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.080 123.3 -0.9 34.5-131.3 -18.7 25.7 49.8 16 17 A I H > S+ 0 0 27 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.927 135.9 53.4 -50.1 -52.7 -17.8 22.5 48.1 17 18 A G H > S+ 0 0 1 -3,-0.5 4,-2.1 -6,-0.2 -1,-0.2 0.921 113.8 41.6 -50.9 -51.3 -18.4 20.4 51.2 18 19 A R H X S+ 0 0 96 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.922 111.8 53.2 -64.8 -47.1 -21.9 21.7 51.7 19 20 A A H X S+ 0 0 8 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.887 110.7 49.7 -56.7 -38.4 -22.9 21.6 48.0 20 21 A I H X S+ 0 0 2 -4,-2.6 4,-2.5 -5,-0.3 5,-0.3 0.946 111.6 48.1 -64.0 -47.9 -21.8 17.9 47.9 21 22 A A H X S+ 0 0 0 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.901 115.7 43.6 -59.4 -44.3 -23.8 17.2 51.0 22 23 A E H X S+ 0 0 72 -4,-3.0 4,-2.9 2,-0.2 -1,-0.2 0.870 113.2 51.3 -70.8 -38.4 -26.9 18.9 49.7 23 24 A T H X S+ 0 0 8 -4,-2.6 4,-1.3 -5,-0.3 -2,-0.2 0.914 111.5 45.7 -68.2 -42.2 -26.6 17.4 46.2 24 25 A L H <>S+ 0 0 1 -4,-2.5 5,-2.3 -5,-0.2 -22,-0.3 0.920 115.8 48.5 -65.5 -40.3 -26.3 13.8 47.4 25 26 A A H ><5S+ 0 0 6 -4,-1.7 3,-1.9 -5,-0.3 -2,-0.2 0.916 108.0 53.2 -63.8 -46.0 -29.2 14.5 49.8 26 27 A A H 3<5S+ 0 0 87 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.793 107.1 54.5 -60.9 -27.5 -31.3 16.0 47.0 27 28 A R T 3<5S- 0 0 96 -4,-1.3 -25,-2.1 -5,-0.2 -1,-0.3 0.160 130.7 -88.0 -95.3 20.0 -30.7 12.9 45.0 28 29 A G T < 5S+ 0 0 25 -3,-1.9 -24,-0.9 1,-0.3 -23,-0.2 0.403 81.5 129.3 98.5 -2.7 -32.0 10.5 47.7 29 30 A A < - 0 0 2 -5,-2.3 2,-0.8 -26,-0.2 -1,-0.3 -0.575 60.0-122.5 -89.7 150.8 -29.0 9.6 50.0 30 31 A K E -a 6 0A 82 -25,-2.4 -23,-2.1 -28,-0.2 2,-0.4 -0.843 41.3-155.2 -88.9 115.2 -29.0 9.9 53.7 31 32 A V E -ac 7 52A 0 20,-1.4 22,-1.9 -2,-0.8 2,-0.6 -0.794 22.4-166.4-103.8 134.4 -26.1 12.3 54.3 32 33 A I E -ac 8 53A 0 -25,-2.7 -23,-2.2 -2,-0.4 2,-0.3 -0.928 16.1-172.1-116.0 104.7 -23.9 12.7 57.3 33 34 A G E -ac 9 54A 0 20,-1.6 22,-2.0 -2,-0.6 2,-0.3 -0.682 10.0-145.8 -94.0 152.1 -21.9 15.9 57.0 34 35 A T E + c 0 55A 3 -25,-1.7 -22,-1.5 -2,-0.3 -21,-0.4 -0.865 19.0 175.4-124.2 157.9 -19.1 16.8 59.4 35 36 A A E - c 0 56A 3 20,-1.7 22,-3.2 -2,-0.3 51,-0.0 -0.902 37.6-121.2-143.9 168.9 -17.5 19.8 61.1 36 37 A T S S+ 0 0 118 -2,-0.3 2,-0.3 20,-0.2 20,-0.1 0.731 95.1 54.8 -86.7 -24.4 -14.9 20.4 63.8 37 38 A S S > S- 0 0 45 1,-0.1 4,-2.1 18,-0.1 5,-0.1 -0.792 82.7-123.9-112.4 153.1 -17.2 22.2 66.1 38 39 A E H > S+ 0 0 124 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.806 113.3 61.0 -60.2 -29.1 -20.6 21.2 67.7 39 40 A N H > S+ 0 0 127 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.989 105.0 45.1 -58.7 -62.5 -21.9 24.4 66.1 40 41 A G H > S+ 0 0 10 2,-0.2 4,-3.5 1,-0.2 5,-0.3 0.888 109.9 54.2 -48.9 -49.4 -21.1 23.3 62.6 41 42 A A H X S+ 0 0 5 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.969 112.8 44.3 -51.3 -56.0 -22.5 19.8 63.1 42 43 A Q H X S+ 0 0 111 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.880 112.6 51.2 -56.5 -42.7 -25.8 21.4 64.3 43 44 A A H X S+ 0 0 53 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.933 112.1 47.8 -61.0 -43.7 -25.7 23.9 61.4 44 45 A I H X S+ 0 0 0 -4,-3.5 4,-2.1 1,-0.2 5,-0.3 0.919 110.2 52.2 -61.6 -44.5 -25.2 21.0 59.0 45 46 A S H X S+ 0 0 19 -4,-3.0 4,-2.0 -5,-0.3 -1,-0.2 0.881 107.8 53.2 -59.7 -39.4 -28.0 19.1 60.7 46 47 A D H < S+ 0 0 110 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.936 112.8 41.1 -64.1 -47.3 -30.3 22.1 60.2 47 48 A Y H < S+ 0 0 46 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.797 117.9 47.2 -74.5 -24.8 -29.7 22.5 56.4 48 49 A L H >< S+ 0 0 4 -4,-2.1 3,-2.1 -5,-0.2 -1,-0.2 0.783 86.3 170.9 -82.5 -27.2 -29.8 18.7 55.8 49 50 A G T 3< - 0 0 43 -4,-2.0 3,-0.5 1,-0.3 -1,-0.2 -0.337 67.7 -8.9 60.0-124.1 -32.9 18.4 57.9 50 51 A A T 3 S+ 0 0 91 1,-0.2 -1,-0.3 -2,-0.1 -2,-0.1 0.462 127.1 73.4 -85.2 -3.5 -34.5 14.9 57.7 51 52 A N S < S- 0 0 85 -3,-2.1 -20,-1.4 -6,-0.1 2,-0.2 0.719 113.8 -32.5 -82.6 -22.3 -32.1 13.9 54.9 52 53 A G E -c 31 0A 11 -3,-0.5 2,-0.3 -22,-0.2 -20,-0.2 -0.811 59.4-104.2-164.7-153.4 -29.2 13.6 57.2 53 54 A K E -c 32 0A 65 -22,-1.9 -20,-1.6 -2,-0.2 2,-0.4 -0.988 19.6-124.0-155.5 156.0 -27.3 14.7 60.3 54 55 A G E -c 33 0A 6 -2,-0.3 2,-0.3 -22,-0.2 -20,-0.2 -0.877 28.0-176.4-106.5 138.5 -24.3 16.7 61.3 55 56 A L E -c 34 0A 18 -22,-2.0 -20,-1.7 -2,-0.4 2,-0.4 -0.979 28.5-115.9-134.3 147.5 -21.6 15.2 63.4 56 57 A M E +c 35 0A 82 -2,-0.3 2,-0.3 -22,-0.2 -20,-0.2 -0.682 43.9 168.8 -82.3 131.8 -18.4 16.6 64.9 57 58 A L - 0 0 6 -22,-3.2 2,-0.5 -2,-0.4 -46,-0.1 -0.999 30.8-161.2-148.1 143.6 -15.3 15.0 63.5 58 59 A N > - 0 0 73 -2,-0.3 3,-1.8 3,-0.3 7,-0.3 -0.962 12.5-157.5-123.7 107.2 -11.5 15.5 63.6 59 60 A V T 3 S+ 0 0 11 -2,-0.5 56,-0.1 1,-0.3 57,-0.1 0.564 92.1 54.2 -64.5 -6.9 -10.0 13.6 60.7 60 61 A T T 3 S+ 0 0 44 1,-0.1 -1,-0.3 55,-0.1 3,-0.1 0.507 91.5 82.6-102.8 -6.1 -6.6 13.6 62.4 61 62 A D <> - 0 0 69 -3,-1.8 4,-2.3 1,-0.2 3,-0.5 -0.840 62.2-161.5-103.9 102.4 -8.0 12.1 65.7 62 63 A P H > S+ 0 0 51 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.791 94.7 53.4 -47.4 -34.7 -8.3 8.2 65.4 63 64 A A H > S+ 0 0 58 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.932 108.1 47.7 -68.0 -48.4 -10.6 8.4 68.4 64 65 A S H > S+ 0 0 22 -3,-0.5 4,-2.7 1,-0.2 5,-0.2 0.875 111.5 52.2 -60.3 -38.9 -12.9 10.9 66.7 65 66 A I H X S+ 0 0 8 -4,-2.3 4,-2.0 -7,-0.3 -1,-0.2 0.938 112.4 43.8 -63.4 -49.0 -12.9 8.9 63.6 66 67 A E H X S+ 0 0 131 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.970 115.5 49.3 -56.0 -60.0 -13.9 5.7 65.4 67 68 A S H X S+ 0 0 45 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.864 110.0 48.7 -48.4 -51.4 -16.5 7.5 67.4 68 69 A V H X S+ 0 0 4 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.919 112.3 48.0 -61.7 -44.3 -18.2 9.3 64.5 69 70 A L H X S+ 0 0 8 -4,-2.0 4,-2.6 -5,-0.2 5,-0.2 0.892 108.3 57.0 -62.3 -38.2 -18.5 6.1 62.5 70 71 A E H X S+ 0 0 125 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.931 106.5 47.9 -56.7 -50.2 -19.9 4.4 65.5 71 72 A K H X S+ 0 0 123 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.785 111.7 52.0 -63.1 -29.6 -22.7 6.9 65.8 72 73 A I H X>S+ 0 0 1 -4,-1.4 5,-2.9 2,-0.2 4,-2.7 0.893 107.1 49.8 -75.8 -42.0 -23.4 6.5 62.1 73 74 A R H <5S+ 0 0 112 -4,-2.6 -2,-0.2 3,-0.2 -1,-0.2 0.829 114.6 48.2 -65.1 -30.1 -23.7 2.7 62.1 74 75 A A H <5S+ 0 0 89 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.914 122.7 28.0 -77.0 -45.5 -26.1 3.1 65.1 75 76 A E H <5S+ 0 0 115 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.2 0.736 143.0 3.9 -90.9 -24.6 -28.4 5.8 63.7 76 77 A F T <5S- 0 0 46 -4,-2.7 2,-0.3 1,-0.2 -3,-0.2 0.689 95.0-120.4-126.4 -50.8 -28.2 5.1 60.0 77 78 A G < - 0 0 20 -5,-2.9 -1,-0.2 -6,-0.0 -3,-0.1 -0.923 55.1 -7.7 137.4-163.1 -26.0 2.1 59.0 78 79 A E S S- 0 0 69 -2,-0.3 2,-0.4 -5,-0.1 -72,-0.2 -0.412 70.3-109.1 -71.6 144.1 -22.9 1.3 57.0 79 80 A V + 0 0 6 1,-0.2 -72,-0.2 -2,-0.1 3,-0.1 -0.612 36.0 173.6 -77.1 124.3 -21.3 4.0 54.9 80 81 A D S S+ 0 0 5 -74,-2.4 51,-2.2 -2,-0.4 2,-0.5 0.764 70.6 37.2 -97.8 -34.8 -21.7 3.4 51.1 81 82 A I E -bd 7 131A 1 -75,-2.6 -73,-2.9 49,-0.2 2,-0.5 -0.972 65.2-169.2-127.4 121.7 -20.2 6.6 49.9 82 83 A L E -bd 8 132A 0 49,-3.1 51,-2.9 -2,-0.5 2,-0.6 -0.940 1.2-173.1-110.8 125.5 -17.2 8.4 51.4 83 84 A V E -bd 9 133A 0 -75,-2.8 -73,-1.8 -2,-0.5 2,-1.0 -0.918 9.6-158.6-120.2 103.6 -16.4 11.9 50.3 84 85 A N E + d 0 134A 7 49,-2.2 51,-3.0 -2,-0.6 -73,-0.1 -0.707 38.8 138.5 -81.1 103.1 -13.1 13.2 51.8 85 86 A N + 0 0 34 -2,-1.0 2,-0.2 -75,-0.5 -1,-0.2 0.402 30.7 113.9-123.9 -4.5 -13.4 16.9 51.5 86 87 A A + 0 0 24 -3,-0.2 2,-0.3 -69,-0.1 -75,-0.1 -0.503 42.2 126.8 -69.7 136.4 -11.9 18.0 54.9 87 88 A G - 0 0 37 -2,-0.2 2,-0.2 25,-0.0 22,-0.1 -0.943 35.5-155.0-179.6 162.1 -8.7 19.8 54.3 88 89 A I - 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0 0 102 -57,-0.3 -55,-2.5 -71,-0.1 2,-0.5 -0.630 52.7-144.3-100.2 154.5 10.1 17.3 35.7 477 234 B T E -m 421 0C 16 -2,-0.2 2,-0.7 -57,-0.2 -55,-0.2 -0.979 10.3-156.5-119.2 122.5 9.8 13.6 36.4 478 235 B L E -m 422 0C 58 -57,-3.4 -55,-2.9 -2,-0.5 2,-0.5 -0.884 10.0-151.4-102.1 111.5 12.2 11.3 34.5 479 236 B H E +m 423 0C 49 -2,-0.7 2,-0.4 -57,-0.2 3,-0.1 -0.704 17.2 178.0 -86.1 126.4 10.8 7.7 34.2 480 237 B V E +m 424 0C 40 -57,-2.4 -55,-1.8 -2,-0.5 -98,-0.1 -0.762 37.0 120.2-127.7 81.4 13.4 5.0 34.0 481 238 B N S > S- 0 0 16 -2,-0.4 3,-1.4 -57,-0.3 -55,-0.3 0.225 78.6-109.3-133.2 15.6 11.4 1.8 33.9 482 239 B G T 3 S- 0 0 42 1,-0.3 -33,-2.0 -3,-0.1 -32,-0.2 0.695 82.0 -55.4 63.9 18.2 12.0 -0.1 30.7 483 240 B G T 3 S+ 0 0 20 2,-0.3 -1,-0.3 -35,-0.2 3,-0.1 0.535 99.5 132.5 91.6 6.4 8.6 0.7 29.3 484 241 B M S < S+ 0 0 23 -3,-1.4 2,-0.3 1,-0.2 -2,-0.1 0.850 84.9 8.7 -57.7 -33.8 6.7 -0.7 32.3 485 242 B Y S S- 0 0 85 -38,-0.0 2,-0.4 0, 0.0 -2,-0.3 -0.992 70.2-161.2-148.1 144.4 4.7 2.5 32.3 486 243 B M 0 0 146 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.988 360.0 360.0-134.6 124.4 4.6 5.4 29.8 487 244 B V 0 0 139 -2,-0.4 -1,-0.1 -8,-0.0 0, 0.0 0.742 360.0 360.0-113.7 360.0 3.3 8.8 30.6