==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE(CHOH(D)-NAD(A)) 25-NOV-87 2LDX . COMPND 2 MOLECULE: APO-LACTATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR J.P.GRIFFITH,M.G.ROSSMANN . 1324 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46916.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1012 76.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 108 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 116 8.8 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 8 0.6 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 . 144 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 160 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 408 30.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 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 4 4 0 0 0 0 4 4 4 4 0 8 0 4 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 8 8 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 . 12 0 8 4 0 0 0 4 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 0 0 0 0 0 4 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 S 0 0 131 0, 0.0 2,-0.2 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -40.6 -37.1 5.7 19.5 2 2 A T > - 0 0 63 1,-0.1 4,-1.4 880,-0.0 5,-0.1 -0.617 360.0-109.2 -90.0 162.2 -34.5 7.2 17.1 3 3 A V H >> S+ 0 0 7 2,-0.2 4,-4.6 -2,-0.2 3,-1.0 0.935 126.5 47.7 -59.1 -48.1 -32.9 5.8 14.0 4 4 A K H 3> S+ 0 0 49 1,-0.3 4,-2.0 2,-0.3 -1,-0.2 0.967 113.6 45.2 -49.3 -65.7 -29.7 5.6 16.1 5 5 A E H 34 S+ 0 0 129 1,-0.2 -1,-0.3 2,-0.2 -2,-0.2 0.601 123.7 40.8 -55.5 -7.7 -31.7 3.9 18.9 6 6 A Q H << S+ 0 0 93 -4,-1.4 -2,-0.3 -3,-1.0 -1,-0.2 0.874 117.5 37.7-109.2 -47.6 -33.2 1.8 16.1 7 7 A L H < S+ 0 0 3 -4,-4.6 1293,-1.4 -5,-0.1 2,-0.4 0.837 111.3 52.3 -77.3 -40.9 -30.4 0.9 13.6 8 8 A I E < -A 1299 0A 22 -4,-2.0 2,-0.6 -5,-0.4 1291,-0.2 -0.876 64.5-151.3-109.7 137.7 -27.5 0.3 15.9 9 9 A Q E -A 1298 0A 58 1289,-4.4 1289,-4.8 -2,-0.4 2,-0.9 -0.891 15.4-137.4-117.1 116.7 -27.1 -1.9 19.0 10 10 A N E -A 1297 0A 108 -2,-0.6 2,-1.9 1287,-0.3 1287,-0.3 -0.481 13.6-139.8 -65.9 88.8 -24.7 -1.0 21.7 11 11 A L - 0 0 17 -2,-0.9 -1,-0.1 1285,-0.8 1284,-0.1 -0.304 36.3-120.0 -66.3 87.8 -22.8 -4.1 22.9 12 12 A V S S+ 0 0 103 -2,-1.9 -1,-0.0 3,-0.1 -3,-0.0 0.414 76.5 28.3 4.3-136.5 -22.8 -3.3 26.6 13 13 A P S S+ 0 0 104 0, 0.0 3,-0.0 0, 0.0 -2,-0.0 -0.094 110.8 40.3 -51.9 138.9 -19.6 -2.9 28.6 14 14 A E + 0 0 69 1,-0.0 -3,-0.1 1137,-0.0 3,-0.1 0.910 59.1 143.6 76.8 82.8 -16.5 -1.7 26.7 15 15 A D + 0 0 85 -5,-0.1 2,-0.2 1,-0.0 1281,-0.1 -0.288 62.5 51.7-140.5 41.6 -17.9 1.0 24.3 16 16 A K + 0 0 161 1277,-0.1 2,-0.2 2,-0.0 -1,-0.0 -0.865 58.0 150.8-175.8 151.5 -14.8 3.3 24.6 17 17 A L - 0 0 82 -2,-0.2 2,-0.2 -3,-0.1 -2,-0.0 -0.804 15.4-164.5-163.3-163.6 -11.0 2.9 24.2 18 18 A S + 0 0 75 -2,-0.2 2,-0.1 2,-0.0 69,-0.1 -0.820 19.6 134.6 171.6 157.8 -7.7 4.6 23.2 19 19 A R + 0 0 134 -2,-0.2 2,-0.7 68,-0.1 27,-0.0 -0.396 50.9 28.5-169.2 -96.9 -4.0 3.9 22.3 20 20 A C + 0 0 51 -2,-0.1 25,-0.6 68,-0.1 26,-0.3 -0.654 57.8 170.7-113.6 94.7 -1.4 5.0 19.7 21 21 A K E -l 88 0B 11 66,-0.7 68,-2.5 -2,-0.7 69,-1.4 -0.208 27.7-144.2 -89.9 166.2 -1.4 8.5 18.1 22 22 A I E -lm 90 47B 1 24,-2.1 26,-2.4 66,-0.2 2,-0.3 -0.915 20.6-173.1-127.9 143.7 0.5 10.9 15.9 23 23 A T E -lm 91 48B 0 67,-1.8 69,-1.8 -2,-0.3 2,-0.4 -0.967 8.9-158.8-139.2 143.6 0.4 14.7 16.5 24 24 A V E -lm 92 49B 0 24,-1.6 26,-1.1 -2,-0.3 2,-0.6 -0.981 13.5-140.9-133.8 120.1 1.9 17.5 14.4 25 25 A V E S-lm 93 50B 3 67,-2.5 69,-1.4 -2,-0.4 26,-0.2 -0.700 75.3 -2.6 -78.9 120.5 2.6 20.9 15.8 26 26 A G - 0 0 2 24,-3.3 25,-0.1 -2,-0.6 24,-0.1 0.643 61.7-134.7 69.3 138.8 1.6 23.6 13.3 27 27 A V + 0 0 0 4,-0.2 -1,-0.1 22,-0.1 2,-0.1 -0.357 43.6 152.7-112.5 35.0 0.4 22.9 9.8 28 28 A G S >> S- 0 0 28 66,-0.6 4,-1.7 1,-0.1 3,-1.5 -0.607 78.6 -77.5 -63.8 140.2 2.5 25.4 7.9 29 29 A D H 3> S+ 0 0 55 1,-0.3 4,-1.4 2,-0.2 5,-0.2 0.562 139.9 43.7 -3.0 -54.5 2.8 23.8 4.4 30 30 A V H >> S+ 0 0 7 2,-0.3 4,-2.4 1,-0.2 3,-0.5 0.941 107.6 53.0 -63.7 -64.0 5.4 21.4 5.9 31 31 A G H <4 S+ 0 0 0 -3,-1.5 -2,-0.2 63,-0.3 -4,-0.2 0.897 118.9 45.3 -41.4 -35.3 3.6 20.6 9.1 32 32 A M H 3X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.3 0.706 108.3 47.9 -79.7 -44.0 0.9 19.8 6.6 33 33 A A H > S+ 0 0 0 -5,-0.3 3,-1.8 2,-0.2 4,-1.6 0.939 105.0 44.4 -89.0 -80.6 0.5 15.4 7.6 36 36 A I H 3X S+ 0 0 10 -4,-1.9 4,-2.0 1,-0.3 5,-0.2 0.748 114.8 52.7 -31.0 -49.0 -1.4 14.1 4.4 37 37 A S H 3< S+ 0 0 2 -4,-1.0 -1,-0.3 2,-0.3 -2,-0.2 0.839 100.1 57.6 -64.3 -41.2 1.5 11.6 3.8 38 38 A I H <4>S+ 0 0 2 -3,-1.8 5,-1.0 -4,-0.4 6,-0.5 0.885 113.1 47.1 -55.8 -26.3 1.3 10.2 7.4 39 39 A L H <5S+ 0 0 6 -4,-1.6 2,-2.8 1,-0.2 33,-0.4 0.900 95.4 67.7 -79.4 -43.0 -2.3 9.6 6.1 40 40 A L T <5S+ 0 0 18 -4,-2.0 2,-0.3 -5,-0.2 -1,-0.2 -0.072 112.7 38.4 -76.0 44.6 -1.4 8.1 2.6 41 41 A K T 5S- 0 0 82 -2,-2.8 2,-0.4 -3,-0.3 31,-0.4 -0.894 98.5-104.0-175.4 176.2 -0.1 5.2 4.7 42 42 A G T 5 + 0 0 42 -2,-0.3 -3,-0.1 1,-0.1 3,-0.1 -0.657 69.7 125.7-120.8 67.4 -1.4 3.6 7.9 43 43 A L S - 0 0 95 1,-0.2 4,-1.3 2,-0.0 3,-0.3 -0.417 66.1-177.4-101.8 48.2 -3.4 29.9 14.2 54 54 A T H > + 0 0 49 -2,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.524 67.9 63.4 -12.4 -40.2 -6.7 28.5 15.2 55 55 A D H 4 S+ 0 0 119 2,-0.2 4,-0.4 1,-0.2 3,-0.2 0.981 107.4 33.9 -60.0 -85.6 -8.3 29.9 12.0 56 56 A K H >> S+ 0 0 51 -3,-0.3 4,-3.5 1,-0.2 3,-0.6 0.685 115.8 61.2 -43.4 -40.0 -6.5 28.0 9.2 57 57 A L H 3X S+ 0 0 0 -4,-1.3 4,-4.3 1,-0.2 5,-0.3 0.997 101.9 45.3 -58.8 -65.6 -6.2 24.9 11.4 58 58 A R H 3< S+ 0 0 156 -4,-1.7 4,-0.2 1,-0.2 -1,-0.2 0.416 118.9 50.2 -58.1 -4.9 -10.0 24.2 11.9 59 59 A G H <> S+ 0 0 0 -3,-0.6 4,-1.1 -4,-0.4 -1,-0.2 0.794 115.9 36.6 -90.3 -60.3 -10.1 24.9 8.2 60 60 A E H X S+ 0 0 1 -4,-3.5 4,-2.1 2,-0.2 3,-0.3 0.867 117.2 54.6 -57.9 -45.9 -7.3 22.5 7.1 61 61 A A H X S+ 0 0 4 -4,-4.3 4,-2.5 -5,-0.2 -1,-0.2 0.963 108.4 47.7 -55.1 -55.0 -8.3 20.0 9.8 62 62 A L H > S+ 0 0 48 -5,-0.3 4,-2.9 1,-0.2 -1,-0.2 0.653 105.7 60.4 -59.4 -25.5 -11.9 19.9 8.4 63 63 A D H X S+ 0 0 0 -4,-1.1 4,-0.9 -3,-0.3 -1,-0.2 0.966 108.6 42.0 -67.1 -53.2 -10.5 19.5 5.0 64 64 A L H >< S+ 0 0 2 -4,-2.1 3,-0.7 1,-0.2 4,-0.3 0.904 114.7 53.8 -58.8 -39.3 -8.8 16.3 6.1 65 65 A Q H >< S+ 0 0 49 -4,-2.5 3,-3.0 1,-0.3 -2,-0.2 0.952 104.9 50.0 -64.2 -51.7 -12.0 15.4 8.0 66 66 A H H 3< S+ 0 0 16 -4,-2.9 -1,-0.3 1,-0.3 3,-0.3 0.721 106.7 64.0 -51.7 -26.2 -14.2 15.8 4.9 67 67 A G T S- 0 0 86 42,-0.0 3,-1.3 -3,-0.0 -30,-0.1 -0.901 88.8-114.9-131.7 162.4 -3.8 23.6 23.1 82 82 A Y G > S+ 0 0 37 -2,-0.3 3,-2.2 1,-0.3 4,-0.2 0.544 100.5 86.3 -74.9 -11.6 -1.6 20.6 23.7 83 83 A N G > S+ 0 0 107 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.839 81.7 66.9 -58.0 -27.0 -4.3 19.0 25.9 84 84 A V G < S+ 0 0 46 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.291 91.2 62.5 -80.4 15.5 -5.4 17.8 22.5 85 85 A S G X + 0 0 0 -3,-2.2 3,-1.0 -62,-0.1 -1,-0.3 0.371 69.2 155.7-121.6 1.3 -2.2 15.7 22.3 86 86 A A T < S- 0 0 40 -3,-1.3 41,-0.1 1,-0.2 -65,-0.1 -0.010 71.2 -1.8 -45.5 113.4 -2.9 13.4 25.2 87 87 A N T 3 S+ 0 0 90 1,-0.2 -66,-0.7 -67,-0.1 -1,-0.2 0.863 82.1 167.9 74.4 43.8 -1.0 10.1 24.9 88 88 A S E < -l 21 0B 5 -3,-1.0 -1,-0.2 -68,-0.1 -66,-0.2 -0.536 29.7-154.8 -76.6 150.7 0.7 10.6 21.5 89 89 A K E S+ 0 0 61 -68,-2.5 42,-0.9 1,-0.3 2,-0.4 0.766 84.1 25.3 -93.6 -30.7 3.4 8.1 20.6 90 90 A L E -lo 22 131B 0 -69,-1.4 -67,-1.8 40,-0.2 2,-0.4 -0.979 64.6-170.3-141.4 123.9 5.0 10.5 18.2 91 91 A V E -lo 23 132B 0 40,-2.2 42,-1.9 -2,-0.4 2,-0.6 -0.930 7.0-161.4-112.2 131.4 5.0 14.3 18.2 92 92 A I E -lo 24 133B 0 -69,-1.8 -67,-2.5 -2,-0.4 2,-0.6 -0.926 7.9-151.8-125.3 108.7 6.4 16.3 15.2 93 93 A I E +lo 25 134B 0 40,-1.6 42,-2.3 -2,-0.6 43,-1.3 -0.678 30.8 153.3 -77.2 112.1 7.3 19.9 15.9 94 94 A T + 0 0 1 -69,-1.4 -66,-0.6 -2,-0.6 2,-0.3 -0.440 35.3 108.0-143.0 62.8 7.0 22.0 12.7 95 95 A A + 0 0 15 -68,-0.1 41,-0.1 -64,-0.1 2,-0.1 -0.981 38.5 77.9-140.6 139.3 6.3 25.5 14.0 96 96 A G S S- 0 0 24 -2,-0.3 2,-0.2 19,-0.1 41,-0.0 -0.433 90.6 -35.9 167.9 -84.6 8.5 28.5 14.1 97 97 A A - 0 0 25 39,-0.1 2,-0.7 -2,-0.1 15,-0.1 -0.584 59.6-148.6 176.6 101.0 9.4 30.9 11.3 98 98 A R - 0 0 63 -2,-0.2 39,-0.0 1,-0.1 -2,-0.0 -0.836 33.5 -54.9-106.1 109.5 9.9 29.4 7.9 99 99 A M - 0 0 21 -2,-0.7 2,-0.2 1,-0.1 -1,-0.1 0.543 33.3-165.8 65.2 154.3 12.2 30.5 5.1 100 100 A V > - 0 0 84 146,-0.0 4,-1.2 2,-0.0 3,-0.2 -0.536 42.8 -96.2-179.5 116.8 12.9 33.6 3.1 101 101 A S T 4 S+ 0 0 83 1,-0.2 2,-0.6 2,-0.2 138,-0.0 -0.061 115.8 2.8 -37.8 101.1 14.9 33.9 -0.2 102 102 A G T 4 S+ 0 0 62 2,-0.1 -1,-0.2 136,-0.0 -3,-0.0 -0.698 118.8 78.5 117.6 -70.8 18.3 34.8 1.2 103 103 A Q T 4 + 0 0 58 -2,-0.6 4,-0.2 -3,-0.2 -2,-0.2 0.826 63.0 107.4 -26.2 -71.1 17.5 34.7 4.9 104 104 A T < + 0 0 23 -4,-1.2 2,-0.3 3,-0.1 -2,-0.1 0.214 43.9 96.0 -35.1 120.7 17.6 30.9 5.3 105 105 A R S S- 0 0 162 88,-0.0 3,-0.4 0, 0.0 -6,-0.1 -0.794 108.0 -53.8-175.8-145.5 20.7 30.0 7.2 106 106 A L S S+ 0 0 46 -2,-0.3 3,-0.4 1,-0.2 4,-0.2 -0.345 109.7 109.0-102.9 38.2 20.6 29.4 11.0 107 107 A D >> + 0 0 85 1,-0.2 2,-1.4 -4,-0.2 3,-0.6 0.858 59.1 68.8 -77.3 -41.8 19.0 32.8 11.1 108 108 A L T 34 S+ 0 0 1 -3,-0.4 4,-0.3 1,-0.2 -1,-0.2 0.027 86.6 96.2 -71.5 37.2 15.6 31.5 12.0 109 109 A L T 3> S+ 0 0 4 -2,-1.4 4,-2.6 -3,-0.4 3,-0.4 0.922 76.1 33.7-102.2 -63.3 17.3 30.6 15.3 110 110 A Q H <> S+ 0 0 116 -3,-0.6 4,-1.3 1,-0.2 -2,-0.1 0.892 121.6 59.8 -61.4 -29.9 17.1 33.0 18.3 111 111 A R H X S+ 0 0 111 -4,-0.5 4,-1.1 1,-0.2 -1,-0.2 0.754 110.4 36.8 -55.8 -42.7 13.7 33.5 16.7 112 112 A N H > S+ 0 0 2 -3,-0.4 4,-3.1 -4,-0.3 -2,-0.2 0.900 101.5 66.4 -91.2 -43.7 12.8 29.8 17.0 113 113 A V H X S+ 0 0 23 -4,-2.6 4,-2.9 1,-0.3 5,-0.2 0.874 107.4 50.7 -43.8 -34.4 14.3 28.8 20.4 114 114 A A H X S+ 0 0 50 -4,-1.3 4,-1.4 2,-0.2 5,-0.3 0.984 105.1 51.9 -64.2 -59.9 11.6 31.4 21.4 115 115 A I H X S+ 0 0 45 -4,-1.1 4,-2.5 1,-0.2 3,-0.3 0.873 116.5 45.8 -40.9 -42.9 9.0 29.5 19.4 116 116 A M H X S+ 0 0 0 -4,-3.1 4,-1.1 2,-0.2 -2,-0.2 0.974 96.3 63.4 -68.8 -74.2 10.2 26.5 21.3 117 117 A K H < S+ 0 0 138 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.652 121.3 31.7 -20.1 -43.7 10.5 27.5 25.0 118 118 A A H < S+ 0 0 63 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.932 124.2 39.2 -75.9 -72.1 6.7 27.9 24.5 119 119 A I H X S+ 0 0 31 -4,-2.5 4,-0.7 -5,-0.3 -3,-0.2 0.916 114.3 46.8 -49.9 -63.6 5.6 25.3 22.0 120 120 A V T >< S+ 0 0 0 -4,-1.1 3,-3.1 2,-0.1 4,-0.3 0.870 101.6 49.0 -56.5-125.2 7.7 22.3 23.0 121 121 A P T 34 S+ 0 0 32 0, 0.0 29,-0.1 0, 0.0 -1,-0.0 -0.056 107.9 49.8 -18.9 116.1 7.7 21.5 26.7 122 122 A G T 3> S+ 0 0 28 -40,-0.1 4,-1.2 28,-0.0 -2,-0.1 -0.592 101.6 64.4 129.9 -55.7 4.1 21.6 27.6 123 123 A V H < S+ 0 0 1 -4,-1.8 3,-2.4 1,-0.2 -1,-0.2 -0.654 75.0 178.2 -96.0 80.0 2.3 12.8 26.4 128 128 A P T 3 S+ 0 0 66 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.670 78.7 41.7 -50.9 -36.1 5.0 12.3 28.9 129 129 A D T 3 S+ 0 0 137 -41,-0.2 -5,-0.0 -3,-0.1 -2,-0.0 -0.059 90.2 135.9-102.2 21.7 6.6 9.2 27.2 130 130 A C < - 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