==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DEHYDRATASE 09-JUL-01 1H7P . COMPND 2 MOLECULE: 5-AMINOLAEVULINIC ACID DEHYDRATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR P.T.ERSKINE,R.NEWBOLD,A.A.BRINDLEY,S.P.WOOD, . 340 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17226.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 234 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.8 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 . 1 0.3 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 . 21 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.8 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 1 1 0 0 1 1 2 2 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 3 2 2 1 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 PARALLEL BRIDGES PER LADDER . 1 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 0 0 1 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 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 1 A M 0 0 228 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.3 31.6 17.5 -45.2 2 2 A H - 0 0 182 3,-0.0 2,-0.3 2,-0.0 0, 0.0 -0.739 360.0-171.1 -74.1 120.7 30.3 16.5 -41.7 3 3 A T - 0 0 108 -2,-0.6 2,-0.6 1,-0.0 0, 0.0 -0.786 30.5 -89.9-116.6 162.1 26.6 17.2 -41.9 4 4 A A - 0 0 70 -2,-0.3 2,-0.3 1,-0.0 -2,-0.0 -0.631 42.2-149.6 -79.1 113.8 23.8 17.2 -39.3 5 5 A E - 0 0 160 -2,-0.6 2,-0.4 0, 0.0 -1,-0.0 -0.650 10.8-167.7 -87.4 135.1 22.2 13.8 -39.2 6 6 A F - 0 0 183 -2,-0.3 2,-0.1 3,-0.0 3,-0.1 -0.987 15.9-137.3-125.8 117.3 18.5 13.4 -38.2 7 7 A L - 0 0 142 -2,-0.4 2,-0.3 1,-0.1 0, 0.0 -0.468 29.4 -99.7 -77.8 149.5 17.2 10.0 -37.4 8 8 A E - 0 0 202 -2,-0.1 2,-0.3 1,-0.0 -1,-0.1 -0.458 49.6-161.6 -61.6 125.4 13.8 8.8 -38.7 9 9 A T - 0 0 129 -2,-0.3 3,-0.1 -3,-0.1 -1,-0.0 -0.766 14.3-126.4-118.7 159.6 11.3 9.3 -35.9 10 10 A E - 0 0 157 -2,-0.3 3,-0.1 1,-0.1 0, 0.0 -0.602 48.5 -75.7 -94.6 161.0 7.8 8.0 -35.0 11 11 A P - 0 0 115 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.228 63.8 -87.2 -57.4 149.0 4.8 10.3 -34.2 12 12 A T - 0 0 116 1,-0.1 2,-0.4 -3,-0.1 3,-0.1 -0.247 38.3-131.1 -57.0 134.4 4.9 11.8 -30.7 13 13 A E > - 0 0 121 1,-0.1 3,-1.6 -3,-0.1 4,-0.5 -0.795 9.6-135.7 -86.7 137.4 3.4 9.7 -27.9 14 14 A I G > S+ 0 0 162 -2,-0.4 3,-1.9 1,-0.3 -1,-0.1 0.890 104.8 63.6 -56.2 -40.9 1.0 11.7 -25.8 15 15 A S G 3 S+ 0 0 103 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.686 97.5 57.3 -55.7 -23.4 2.6 10.0 -22.7 16 16 A S G < S+ 0 0 83 -3,-1.6 2,-0.9 1,-0.1 -1,-0.3 0.688 84.7 94.4 -78.2 -19.0 5.9 11.8 -23.6 17 17 A V < + 0 0 88 -3,-1.9 -1,-0.1 -4,-0.5 3,-0.0 -0.722 28.5 142.6 -96.3 101.2 4.5 15.4 -23.5 18 18 A L > + 0 0 128 -2,-0.9 3,-2.2 1,-0.1 4,-0.2 0.510 51.3 90.2 -96.7 -21.2 4.8 17.2 -20.2 19 19 A A G > + 0 0 58 1,-0.3 3,-1.7 2,-0.2 4,-0.3 0.742 68.8 73.4 -61.6 -26.7 5.5 20.7 -21.6 20 20 A G G 3 S+ 0 0 57 1,-0.3 -1,-0.3 2,-0.1 3,-0.3 0.702 93.9 59.4 -61.1 -18.1 1.9 21.9 -21.8 21 21 A G G < S+ 0 0 23 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.584 113.5 26.5 -90.6 -5.5 2.1 22.1 -18.0 22 22 A Y S < S+ 0 0 135 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.1 0.092 76.8 111.9-146.4 35.4 4.9 24.7 -17.5 23 23 A N S S+ 0 0 108 -4,-0.3 -1,-0.1 -3,-0.3 -3,-0.1 0.282 74.4 52.3 -93.9 12.5 5.3 27.0 -20.5 24 24 A H S > S- 0 0 100 1,-0.1 4,-1.5 -3,-0.1 3,-0.5 -0.985 85.1-114.4-144.8 147.4 4.1 30.2 -18.8 25 25 A P H > S+ 0 0 76 0, 0.0 4,-0.9 0, 0.0 3,-0.1 0.843 116.2 52.6 -52.7 -40.3 5.2 32.1 -15.6 26 26 A L H >> S+ 0 0 76 1,-0.2 4,-2.0 2,-0.2 3,-0.7 0.894 105.4 55.2 -66.3 -36.3 1.8 31.5 -13.9 27 27 A L H 3> S+ 0 0 28 -3,-0.5 4,-1.8 1,-0.3 -1,-0.2 0.842 97.6 61.4 -63.8 -34.7 2.0 27.7 -14.6 28 28 A R H 3< S+ 0 0 140 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.861 109.0 45.3 -68.1 -21.6 5.3 27.5 -12.8 29 29 A Q H X< S+ 0 0 97 -4,-0.9 3,-1.7 -3,-0.7 -2,-0.2 0.888 108.1 54.8 -76.3 -45.5 3.2 28.7 -9.8 30 30 A W H 3< S+ 0 0 185 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.765 101.7 61.7 -52.0 -31.5 0.3 26.3 -10.5 31 31 A Q T 3< S+ 0 0 120 -4,-1.8 2,-0.3 -5,-0.2 -1,-0.3 0.603 83.1 97.4 -81.2 -9.9 2.9 23.5 -10.4 32 32 A S < - 0 0 48 -3,-1.7 3,-0.2 1,-0.1 -3,-0.0 -0.614 61.4-157.1 -79.1 134.4 3.8 24.2 -6.8 33 33 A E S S+ 0 0 172 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.718 85.7 21.2 -82.7 -15.1 2.1 22.1 -4.2 34 34 A R S S- 0 0 84 282,-0.1 2,-0.3 -3,-0.0 -1,-0.3 -0.918 73.7-147.7-153.2 126.1 2.7 24.8 -1.6 35 35 A Q - 0 0 118 -2,-0.3 2,-0.3 -3,-0.2 -6,-0.0 -0.694 27.5-109.0 -92.9 144.0 3.4 28.5 -2.0 36 36 A L + 0 0 22 -2,-0.3 2,-0.3 2,-0.0 -1,-0.1 -0.541 42.2 175.1 -69.8 124.3 5.6 30.6 0.3 37 37 A T > - 0 0 61 -2,-0.3 3,-1.6 1,-0.1 4,-0.2 -0.916 41.6-110.4-126.5 161.2 3.6 33.0 2.5 38 38 A K G > S+ 0 0 49 -2,-0.3 3,-2.0 1,-0.3 46,-0.3 0.814 111.3 62.4 -55.8 -41.2 4.7 35.4 5.3 39 39 A N G 3 S+ 0 0 94 1,-0.3 -1,-0.3 44,-0.1 43,-0.0 0.512 92.3 66.5 -71.2 -6.6 2.9 33.5 8.1 40 40 A M G < S+ 0 0 21 -3,-1.6 286,-2.7 285,-0.1 2,-0.3 0.571 83.4 100.8 -83.4 -9.9 5.1 30.4 7.4 41 41 A L E < -a 326 0A 1 -3,-2.0 43,-0.5 -4,-0.2 44,-0.5 -0.645 49.0-173.6 -86.9 132.7 8.1 32.3 8.6 42 42 A I E -a 327 0A 7 284,-2.7 286,-2.0 -2,-0.3 44,-0.2 -0.988 11.0-156.5-123.9 122.5 9.7 31.9 12.0 43 43 A F E -e 86 0B 2 42,-2.0 44,-1.5 -2,-0.4 286,-0.1 -0.864 11.7-133.0-105.6 120.6 12.5 34.3 13.0 44 44 A P E -e 87 0B 2 0, 0.0 2,-0.4 0, 0.0 44,-0.2 -0.403 17.1-162.7 -68.1 142.2 15.1 33.4 15.6 45 45 A L E -e 88 0B 3 42,-2.5 44,-2.4 -2,-0.1 2,-0.7 -0.999 9.3-151.9-124.1 131.0 16.0 36.0 18.3 46 46 A F E -ef 89 65B 1 18,-0.6 20,-3.0 -2,-0.4 2,-0.6 -0.913 19.0-157.1-101.7 103.9 19.2 35.7 20.4 47 47 A I E -ef 90 66B 0 42,-3.2 44,-2.9 -2,-0.7 20,-0.2 -0.772 2.4-153.2 -97.8 122.6 18.4 37.4 23.7 48 48 A S E -e 91 0B 2 18,-1.9 20,-0.4 -2,-0.6 5,-0.1 -0.491 20.7-132.1 -81.1 153.8 21.3 38.7 25.8 49 49 A D S S+ 0 0 32 42,-0.8 -1,-0.1 -2,-0.2 18,-0.1 0.368 93.4 86.4 -90.2 6.8 21.2 39.2 29.6 50 50 A N S > S- 0 0 75 1,-0.1 3,-2.6 44,-0.0 -2,-0.2 -0.913 76.3-152.8 -95.3 105.0 22.6 42.7 29.0 51 51 A P T 3 S+ 0 0 58 0, 0.0 18,-1.6 0, 0.0 19,-0.3 0.617 90.8 49.7 -58.9 -15.1 19.4 44.5 28.4 52 52 A D T 3 S+ 0 0 98 17,-0.1 -3,-0.0 16,-0.1 -2,-0.0 0.343 84.0 129.8-107.7 8.2 21.0 47.2 26.3 53 53 A D < + 0 0 18 -3,-2.6 14,-2.6 1,-0.1 17,-0.1 -0.266 18.8 157.1 -59.6 142.8 22.9 44.7 24.0 54 54 A F E +G 66 0B 68 12,-0.2 2,-0.5 2,-0.1 12,-0.2 -0.323 23.9 164.1-161.6 62.3 22.7 45.0 20.2 55 55 A T E -G 65 0B 63 10,-2.0 10,-3.3 1,-0.0 2,-0.2 -0.756 36.0-128.2 -98.4 121.6 25.8 43.1 19.2 56 56 A E E -G 64 0B 147 -2,-0.5 2,-0.8 8,-0.3 8,-0.3 -0.515 19.3-131.5 -68.7 137.6 26.4 41.9 15.7 57 57 A I > - 0 0 9 6,-2.6 3,-2.0 3,-0.4 6,-0.4 -0.870 16.5-147.0 -94.6 105.5 27.3 38.2 15.5 58 58 A D T 3 S+ 0 0 161 -2,-0.8 -1,-0.2 1,-0.3 4,-0.1 0.792 92.1 40.8 -41.2 -59.0 30.4 38.1 13.3 59 59 A S T 3 S+ 0 0 37 1,-0.2 -1,-0.3 159,-0.1 160,-0.1 0.517 108.1 65.3 -74.7 -11.8 29.8 34.7 11.6 60 60 A L S X S- 0 0 0 -3,-2.0 3,-1.9 3,-0.2 -3,-0.4 -0.844 90.2-133.1-118.7 92.4 26.1 35.2 11.2 61 61 A P T 3 S- 0 0 35 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.067 78.8 -2.4 -54.0 135.7 25.5 38.0 8.8 62 62 A N T 3 S+ 0 0 117 1,-0.2 2,-0.4 -4,-0.1 -4,-0.1 0.598 104.6 116.6 64.2 11.5 23.0 40.7 9.6 63 63 A I < - 0 0 5 -3,-1.9 -6,-2.6 -6,-0.4 2,-0.3 -0.941 44.3-168.1-113.6 135.1 22.1 38.9 12.9 64 64 A N E - G 0 56B 20 -2,-0.4 -18,-0.6 -8,-0.3 2,-0.5 -0.780 28.0-120.7-116.0 161.1 22.6 40.4 16.4 65 65 A R E -fG 46 55B 26 -10,-3.3 -10,-2.0 -2,-0.3 2,-0.4 -0.882 45.2-163.5 -89.2 129.8 22.5 39.4 20.0 66 66 A I E -fG 47 54B 2 -20,-3.0 -18,-1.9 -2,-0.5 -12,-0.2 -0.956 17.8-144.5-131.4 134.3 19.9 41.7 21.6 67 67 A G >> - 0 0 0 -14,-2.6 3,-2.3 -2,-0.4 4,-0.6 -0.539 35.9-104.6 -88.7 161.5 18.9 42.8 25.0 68 68 A V H >> S+ 0 0 22 -20,-0.4 3,-1.0 1,-0.3 4,-0.5 0.829 117.2 59.2 -56.1 -38.2 15.3 43.5 26.1 69 69 A N H 34 S+ 0 0 106 -18,-1.6 -1,-0.3 1,-0.2 4,-0.2 0.477 109.6 46.7 -74.8 2.0 15.6 47.3 26.1 70 70 A R H <> S+ 0 0 105 -3,-2.3 4,-1.0 -19,-0.3 -1,-0.2 0.463 91.3 84.3-113.0 -7.0 16.5 47.0 22.4 71 71 A L H S+ 0 0 61 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.845 116.5 54.7 -66.2 -28.9 9.3 47.2 11.6 78 78 A L H <>S+ 0 0 17 -4,-0.5 5,-2.1 2,-0.2 3,-0.3 0.955 110.1 42.9 -67.5 -48.9 9.3 43.4 11.4 79 79 A V H ><5S+ 0 0 50 -4,-2.9 3,-1.7 1,-0.2 -1,-0.2 0.899 111.5 57.2 -62.5 -38.1 5.9 42.9 12.9 80 80 A A H 3<5S+ 0 0 85 -4,-2.2 -1,-0.2 -5,-0.4 -2,-0.2 0.841 105.2 50.9 -61.9 -34.0 4.6 45.8 10.8 81 81 A K T 3<5S- 0 0 85 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.268 134.5 -83.2 -87.3 7.4 5.8 43.9 7.6 82 82 A G T < 5 + 0 0 23 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.564 66.7 161.8 111.1 5.8 3.9 40.7 8.6 83 83 A L < + 0 0 6 -5,-2.1 -1,-0.2 1,-0.1 -44,-0.1 -0.398 7.4 175.0 -61.6 129.4 6.1 38.8 11.0 84 84 A R + 0 0 137 -43,-0.5 43,-2.5 -46,-0.3 2,-0.3 0.619 55.5 25.1-109.4 -23.2 3.9 36.2 12.9 85 85 A S E - h 0 127B 10 -44,-0.5 -42,-2.0 41,-0.2 2,-0.3 -0.998 51.1-169.5-150.8 147.0 6.3 34.2 15.0 86 86 A V E -eh 43 128B 0 41,-2.0 43,-2.6 -2,-0.3 2,-0.5 -0.954 14.6-144.7-131.9 154.8 9.7 34.2 16.7 87 87 A I E -eh 44 129B 0 -44,-1.5 -42,-2.5 -2,-0.3 2,-0.4 -0.986 23.5-141.1-122.6 122.5 11.9 31.5 18.3 88 88 A L E -eh 45 130B 1 41,-2.9 43,-2.2 -2,-0.5 2,-0.4 -0.689 18.3-176.6 -94.8 137.7 13.8 32.6 21.3 89 89 A F E -e 46 0B 3 -44,-2.4 -42,-3.2 -2,-0.4 2,-0.4 -0.991 20.3-138.3-124.5 131.0 17.3 31.6 22.3 90 90 A G E -e 47 0B 1 -2,-0.4 -42,-0.2 -44,-0.2 -44,-0.0 -0.733 16.8-176.4 -92.6 135.2 18.9 32.8 25.5 91 91 A V E -e 48 0B 2 -44,-2.9 -42,-0.8 -2,-0.4 2,-0.4 -0.575 8.5-171.9-123.7 71.0 22.5 33.9 25.6 92 92 A P + 0 0 6 0, 0.0 6,-0.1 0, 0.0 5,-0.1 -0.466 10.1 172.9 -66.8 120.9 23.4 34.7 29.3 93 93 A L + 0 0 78 -2,-0.4 3,-0.1 2,-0.1 4,-0.1 0.619 38.6 113.2-105.2 -10.7 26.8 36.3 29.4 94 94 A I S > S- 0 0 100 1,-0.1 3,-0.8 2,-0.1 4,-0.2 -0.394 75.8-107.7 -60.4 130.5 27.0 37.3 33.1 95 95 A P T 3 S+ 0 0 120 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.180 97.7 28.4 -61.0 150.8 29.7 35.2 34.8 96 96 A G T 3 S+ 0 0 86 -3,-0.1 -2,-0.1 2,-0.1 -3,-0.0 0.666 88.5 109.9 74.2 20.1 28.9 32.4 37.2 97 97 A T < + 0 0 37 -3,-0.8 7,-0.5 -5,-0.1 2,-0.2 0.886 58.1 74.4 -89.3 -43.7 25.5 31.8 35.5 98 98 A K + 0 0 75 -4,-0.2 40,-0.2 40,-0.1 -2,-0.1 -0.446 57.2 162.4 -72.7 138.8 26.3 28.4 33.9 99 99 A D B > -k 138 0C 47 38,-1.6 3,-1.5 -2,-0.2 40,-0.7 -0.914 52.7 -88.7-147.3 171.2 26.4 25.3 36.0 100 100 A P T 3 S+ 0 0 80 0, 0.0 46,-0.4 0, 0.0 38,-0.1 0.717 123.9 42.0 -58.9 -23.2 26.3 21.5 35.5 101 101 A V T 3 S- 0 0 58 44,-0.1 37,-0.1 36,-0.1 44,-0.1 0.305 108.5-116.8-108.1 11.8 22.5 21.2 35.7 102 102 A G X + 0 0 0 -3,-1.5 3,-2.1 35,-0.3 4,-0.3 0.891 47.7 170.6 59.7 39.6 21.7 24.3 33.6 103 103 A T G > S+ 0 0 77 1,-0.3 3,-0.8 34,-0.2 -5,-0.1 0.854 71.3 55.6 -47.5 -41.9 20.0 26.0 36.6 104 104 A A G > S+ 0 0 13 -7,-0.5 3,-1.8 33,-0.3 -1,-0.3 0.549 78.0 95.2 -75.5 -9.1 19.7 29.3 34.7 105 105 A A G < S+ 0 0 4 -3,-2.1 -1,-0.2 1,-0.3 7,-0.1 0.861 101.8 24.0 -49.1 -42.7 17.8 27.8 31.8 106 106 A D G < S+ 0 0 22 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.1 -0.045 83.8 147.5-116.0 30.1 14.5 28.8 33.5 107 107 A D X - 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