==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-APR-10 3MQ2 . COMPND 2 MOLECULE: 16S RRNA METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES SP. DSM 40477; . AUTHOR R.A.MACMASTER . 432 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20167.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 335 77.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 11.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 12.5 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 . 2 0.5 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 . 2 0.5 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 . 36 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 17.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 21.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.8 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 2 2 2 7 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 0 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 PARALLEL BRIDGES PER LADDER . 4 0 0 2 0 0 2 2 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 2 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 25 0, 0.0 11,-2.4 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 142.9 9.8 7.7 16.0 2 2 A R E -A 11 0A 23 9,-0.2 82,-2.3 82,-0.2 9,-0.3 -0.873 360.0-155.0-118.4 98.2 10.6 3.9 15.9 3 3 A R E -AB 10 83A 91 7,-2.6 7,-2.6 -2,-0.7 2,-0.5 -0.502 4.5-147.8 -76.7 137.2 13.6 3.1 13.8 4 4 A V E +A 9 0A 3 78,-2.8 78,-0.4 5,-0.2 2,-0.4 -0.921 23.0 166.8-104.7 126.0 13.9 -0.4 12.3 5 5 A V E > -A 8 0A 42 3,-2.8 3,-2.3 -2,-0.5 2,-0.2 -0.884 68.3 -54.2-136.7 107.7 17.3 -2.0 11.8 6 6 A G T 3 S- 0 0 10 56,-0.7 59,-0.1 55,-0.4 55,-0.1 -0.455 121.1 -21.6 58.0-128.2 17.1 -5.7 11.0 7 7 A K T 3 S+ 0 0 172 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.421 120.9 98.6 -89.3 1.5 15.1 -7.3 13.8 8 8 A R E < -A 5 0A 161 -3,-2.3 -3,-2.8 54,-0.1 2,-0.4 -0.716 53.3-164.6 -92.6 138.6 15.8 -4.3 16.2 9 9 A V E -A 4 0A 46 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.981 9.2-175.9-113.8 134.4 13.4 -1.5 16.8 10 10 A Q E -A 3 0A 97 -7,-2.6 -7,-2.6 -2,-0.4 2,-0.1 -0.950 16.5-143.3-132.3 116.3 14.8 1.6 18.5 11 11 A E E +A 2 0A 130 -2,-0.4 2,-0.3 -9,-0.3 -9,-0.2 -0.459 25.5 178.5 -67.1 143.9 12.7 4.6 19.5 12 12 A F - 0 0 29 -11,-2.4 2,-0.1 -2,-0.1 -2,-0.0 -0.976 27.0 -94.2-147.2 164.8 14.4 8.0 19.1 13 13 A S > - 0 0 57 -2,-0.3 4,-1.9 1,-0.1 3,-0.2 -0.322 20.4-124.9 -85.5 155.7 13.5 11.6 19.6 14 14 A D H > S+ 0 0 102 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.843 114.8 59.6 -60.6 -31.5 12.1 14.2 17.2 15 15 A A H > S+ 0 0 59 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.884 104.2 48.9 -63.6 -39.1 15.0 16.3 18.3 16 16 A E H > S+ 0 0 107 -3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.881 110.4 51.2 -67.5 -38.5 17.4 13.7 17.0 17 17 A F H X S+ 0 0 1 -4,-1.9 4,-3.1 2,-0.2 5,-0.2 0.920 107.6 53.4 -62.4 -43.5 15.4 13.5 13.7 18 18 A E H X S+ 0 0 75 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.897 107.2 50.5 -60.6 -42.0 15.7 17.2 13.3 19 19 A Q H < S+ 0 0 133 -4,-1.8 4,-0.4 2,-0.2 -1,-0.2 0.901 113.7 46.4 -62.3 -40.7 19.5 17.2 13.7 20 20 A L H >< S+ 0 0 47 -4,-1.8 3,-1.8 1,-0.2 4,-0.2 0.971 113.4 46.8 -63.7 -54.7 19.7 14.4 11.1 21 21 A R H >< S+ 0 0 40 -4,-3.1 3,-2.2 1,-0.3 -1,-0.2 0.815 99.4 69.4 -58.3 -33.8 17.3 16.1 8.6 22 22 A S T 3< S+ 0 0 89 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.674 92.4 60.6 -64.7 -14.3 19.1 19.5 9.0 23 23 A Q T < S+ 0 0 136 -3,-1.8 -1,-0.3 -4,-0.4 2,-0.3 0.542 99.2 68.5 -88.0 -9.1 22.1 18.0 7.2 24 24 A Y S < S- 0 0 41 -3,-2.2 25,-0.2 -4,-0.2 3,-0.1 -0.721 80.0-126.4-114.3 161.4 20.1 17.3 4.0 25 25 A D S S- 0 0 134 23,-3.0 2,-0.3 -2,-0.3 24,-0.2 0.832 85.5 -18.2 -72.7 -33.8 18.6 19.4 1.3 26 26 A D E -c 49 0A 32 22,-0.6 24,-2.8 2,-0.0 2,-0.4 -0.964 63.3-110.6-164.2 171.7 15.1 17.9 1.6 27 27 A V E -c 50 0A 2 68,-0.4 70,-2.5 -2,-0.3 71,-1.1 -0.962 17.2-164.9-122.2 135.3 13.2 14.8 2.8 28 28 A V E -cd 51 98A 1 22,-2.5 24,-3.1 -2,-0.4 2,-0.4 -0.952 11.3-159.3-112.9 136.8 11.4 12.1 0.8 29 29 A L E -cd 52 99A 0 69,-2.7 71,-2.9 -2,-0.4 2,-0.6 -0.978 7.7-162.8-121.9 127.7 8.9 9.9 2.5 30 30 A D E -cd 53 100A 1 22,-2.7 24,-2.6 -2,-0.4 2,-0.5 -0.946 13.0-156.8-107.1 118.8 7.8 6.4 1.2 31 31 A V E S+c 54 0A 0 69,-2.7 71,-0.5 -2,-0.6 24,-0.1 -0.843 76.3 10.6-100.7 123.3 4.5 5.3 2.9 32 32 A G S S+ 0 0 1 22,-1.4 23,-0.3 -2,-0.5 -1,-0.2 0.938 76.3 172.6 76.8 52.4 3.8 1.6 3.0 33 33 A T > - 0 0 1 21,-2.8 3,-2.2 -3,-0.4 5,-0.3 0.606 11.7-170.1 -78.8 -14.4 7.3 0.7 1.8 34 34 A G T 3 S+ 0 0 0 1,-0.3 -1,-0.2 20,-0.2 -2,-0.1 -0.402 75.6 2.1 65.0-127.6 7.1 -3.1 2.3 35 35 A D T 3 S- 0 0 25 398,-0.3 29,-0.4 -2,-0.2 -1,-0.3 0.597 98.7-126.7 -71.6 -7.5 10.5 -4.7 1.8 36 36 A G <> + 0 0 0 -3,-2.2 4,-1.3 18,-0.1 -2,-0.1 0.615 67.2 132.3 81.2 13.1 12.0 -1.2 1.3 37 37 A K H > + 0 0 74 -4,-0.3 4,-2.0 1,-0.2 154,-0.2 0.878 69.0 56.8 -65.4 -37.0 13.8 -1.7 -2.0 38 38 A H H > S+ 0 0 9 -5,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.954 107.4 43.7 -63.5 -53.0 12.4 1.5 -3.5 39 39 A P H > S+ 0 0 1 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.821 108.6 60.4 -66.1 -25.4 13.6 4.0 -0.9 40 40 A Y H X S+ 0 0 30 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.949 108.3 44.5 -63.0 -46.4 17.0 2.2 -0.9 41 41 A K H X S+ 0 0 54 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.939 112.9 51.2 -59.2 -47.5 17.2 3.1 -4.6 42 42 A V H X S+ 0 0 13 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.935 112.6 45.2 -57.6 -46.6 16.0 6.6 -4.0 43 43 A A H < S+ 0 0 1 -4,-3.0 3,-0.3 1,-0.2 -1,-0.2 0.912 112.3 52.1 -63.8 -41.9 18.5 7.2 -1.2 44 44 A R H < S+ 0 0 121 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.910 116.4 39.7 -58.8 -42.8 21.3 5.7 -3.3 45 45 A Q H < S+ 0 0 121 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.602 117.9 48.9 -87.0 -12.5 20.5 8.0 -6.2 46 46 A N >< + 0 0 46 -4,-1.4 3,-2.0 -3,-0.3 -1,-0.2 -0.584 60.4 167.3-128.1 69.5 19.8 11.1 -4.2 47 47 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.678 75.7 57.2 -58.6 -21.8 22.8 11.5 -1.7 48 48 A S T 3 S+ 0 0 61 -24,-0.1 -23,-3.0 2,-0.1 -22,-0.6 0.445 98.1 70.7 -93.4 -0.5 21.7 15.0 -0.8 49 49 A R E < S-c 26 0A 47 -3,-2.0 2,-0.5 -25,-0.2 -22,-0.2 -0.883 78.1-126.6-116.6 148.4 18.2 14.1 0.4 50 50 A L E -c 27 0A 0 -24,-2.8 -22,-2.5 -2,-0.3 2,-0.5 -0.826 24.4-154.6 -90.8 127.1 17.1 12.2 3.5 51 51 A V E -ce 28 80A 0 28,-2.9 30,-2.4 -2,-0.5 2,-0.4 -0.914 10.3-172.8-109.3 123.4 14.8 9.3 2.6 52 52 A V E -ce 29 81A 0 -24,-3.1 -22,-2.7 -2,-0.5 2,-0.4 -0.934 4.8-178.0-113.3 135.9 12.4 8.1 5.2 53 53 A A E -ce 30 82A 0 28,-2.7 30,-3.0 -2,-0.4 2,-0.3 -0.998 1.3-175.6-136.9 139.0 10.3 5.0 4.6 54 54 A L E +ce 31 83A 0 -24,-2.6 -21,-2.8 -2,-0.4 -22,-1.4 -0.937 9.0 177.2-134.9 156.0 7.7 3.4 6.8 55 55 A D E - e 0 84A 0 28,-1.5 30,-1.6 -2,-0.3 31,-0.1 -0.979 35.4-128.9-150.2 152.4 5.5 0.3 7.0 56 56 A A S S+ 0 0 19 -2,-0.3 2,-0.7 28,-0.2 30,-0.1 0.749 100.1 65.6 -67.6 -26.0 3.0 -1.1 9.4 57 57 A D >> - 0 0 65 1,-0.2 3,-1.0 28,-0.1 4,-0.6 -0.853 63.5-171.4-106.2 104.5 4.8 -4.4 9.3 58 58 A K G >4 S+ 0 0 84 -2,-0.7 3,-0.8 1,-0.2 4,-0.3 0.804 80.1 67.0 -65.8 -28.8 8.4 -4.2 10.8 59 59 A S G >4 S+ 0 0 72 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.811 91.6 61.8 -63.2 -30.5 9.3 -7.7 9.7 60 60 A R G <4 S+ 0 0 92 -3,-1.0 4,-0.3 1,-0.3 3,-0.2 0.835 103.6 48.9 -64.6 -33.1 9.2 -6.8 6.0 61 61 A M G S+ 0 0 76 -3,-1.2 4,-1.8 -4,-0.3 -56,-0.7 0.927 81.1 39.4 -53.8 -60.8 14.4 -6.5 8.2 63 63 A K H > S+ 0 0 125 -4,-0.3 4,-1.9 -3,-0.2 -1,-0.2 0.928 120.5 40.8 -58.5 -52.4 16.9 -7.4 5.5 64 64 A I H > S+ 0 0 9 -29,-0.4 4,-2.7 -4,-0.3 -1,-0.2 0.872 113.0 53.4 -71.7 -35.8 17.2 -4.0 3.7 65 65 A S H X S+ 0 0 1 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.867 109.3 50.4 -66.0 -34.6 17.2 -1.9 6.9 66 66 A A H < S+ 0 0 44 -4,-1.8 3,-0.3 -5,-0.3 4,-0.3 0.920 112.2 46.9 -66.8 -43.5 20.1 -4.0 8.2 67 67 A K H >< S+ 0 0 91 -4,-1.9 3,-1.6 1,-0.2 -2,-0.2 0.920 110.0 52.8 -63.4 -43.8 22.0 -3.5 5.0 68 68 A A H 3< S+ 0 0 3 -4,-2.7 9,-2.6 1,-0.3 -1,-0.2 0.753 108.0 52.0 -65.5 -24.0 21.3 0.2 4.9 69 69 A A T 3< S+ 0 0 47 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.420 95.4 92.7 -92.6 0.6 22.6 0.6 8.5 70 70 A A S < S- 0 0 42 -3,-1.6 5,-0.1 -4,-0.3 -3,-0.1 -0.144 93.9 -67.4 -82.6-179.6 25.9 -1.2 7.7 71 71 A K > > - 0 0 169 1,-0.1 5,-2.2 5,-0.1 3,-2.1 -0.403 50.4-109.1 -67.7 151.4 29.1 0.4 6.6 72 72 A P G > 5S+ 0 0 101 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.827 118.3 59.0 -48.5 -40.7 29.1 2.0 3.1 73 73 A A G 3 5S+ 0 0 99 1,-0.3 -2,-0.0 2,-0.1 -3,-0.0 0.711 107.7 47.6 -66.2 -19.2 31.3 -0.7 1.6 74 74 A K G < 5S- 0 0 163 -3,-2.1 -1,-0.3 -7,-0.1 -4,-0.1 0.151 136.8 -80.9-107.9 15.8 28.6 -3.2 2.6 75 75 A G T < 5S+ 0 0 8 -3,-1.8 -2,-0.1 1,-0.3 -4,-0.1 0.507 77.2 155.5 101.1 6.9 25.7 -1.3 1.2 76 76 A G < - 0 0 5 -5,-2.2 -1,-0.3 -7,-0.1 -8,-0.2 -0.363 22.7-165.7 -66.6 145.3 25.2 1.2 4.1 77 77 A L > - 0 0 18 -9,-2.6 3,-0.7 3,-0.1 -33,-0.1 -0.992 15.0-160.3-134.2 126.3 23.5 4.5 3.4 78 78 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.701 89.1 59.6 -76.1 -20.2 23.5 7.4 5.8 79 79 A N T 3 S+ 0 0 4 -36,-0.1 -28,-2.9 -29,-0.1 2,-0.4 -0.108 88.0 88.0-104.0 33.6 20.5 9.2 4.2 80 80 A L E < + e 0 51A 8 -3,-0.7 2,-0.4 -30,-0.2 -28,-0.2 -0.994 47.3 179.4-139.5 127.6 18.0 6.4 4.7 81 81 A L E - e 0 52A 7 -30,-2.4 -28,-2.7 -2,-0.4 2,-0.5 -0.989 12.0-157.6-134.4 121.6 15.8 5.8 7.7 82 82 A Y E - e 0 53A 5 -2,-0.4 -78,-2.8 -78,-0.4 2,-0.3 -0.872 16.8-170.5 -99.3 131.5 13.2 3.0 8.0 83 83 A L E -Be 3 54A 1 -30,-3.0 -28,-1.5 -2,-0.5 2,-0.8 -0.909 24.2-128.8-125.1 150.1 10.4 3.5 10.6 84 84 A W E + e 0 55A 30 -82,-2.3 2,-0.3 -2,-0.3 -82,-0.2 -0.851 58.8 116.2 -98.1 109.3 7.7 1.3 12.0 85 85 A A - 0 0 0 -30,-1.6 2,-0.2 -2,-0.8 -53,-0.2 -0.972 54.3-121.6-168.9 153.2 4.4 3.1 11.6 86 86 A T - 0 0 13 3,-0.5 3,-0.5 -2,-0.3 -31,-0.1 -0.653 29.4-118.3 -96.9 161.6 0.9 3.0 9.9 87 87 A A S > S+ 0 0 3 -2,-0.2 3,-0.5 1,-0.2 -1,-0.1 0.770 116.4 58.5 -67.1 -24.3 -0.5 5.6 7.6 88 88 A E T 3 S+ 0 0 65 1,-0.3 -1,-0.2 34,-0.0 2,-0.2 0.801 118.1 30.1 -71.3 -31.3 -3.3 6.1 10.2 89 89 A R T 3 S- 0 0 18 -3,-0.5 -3,-0.5 328,-0.1 -1,-0.3 -0.586 86.1-173.3-129.9 69.7 -0.7 7.0 12.9 90 90 A L < - 0 0 14 -3,-0.5 -3,-0.1 -2,-0.2 -5,-0.0 -0.217 31.1 -99.0 -64.7 152.9 2.2 8.6 11.1 91 91 A P - 0 0 10 0, 0.0 2,-2.8 0, 0.0 -1,-0.1 -0.230 49.0 -88.6 -62.6 161.6 5.4 9.5 12.9 92 92 A P S S+ 0 0 76 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.339 73.4 153.4 -74.2 59.7 5.9 13.2 13.9 93 93 A L - 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