==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 06-DEC-10 3PUQ . COMPND 2 MOLECULE: LYSINE-SPECIFIC DEMETHYLASE 7 HOMOLOG; . SOURCE 2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS; . AUTHOR Y.YANG,P.WANG,W.XU,Y.XU . 943 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46053.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 651 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 142 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 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 . 1 0.1 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 . 57 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 113 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 270 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.2 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 3 2 2 0 3 1 6 2 2 0 0 0 0 2 0 0 0 0 0 1 3 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 0 PARALLEL BRIDGES PER LADDER . 1 2 6 6 2 4 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 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 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 1 191 A T 0 0 157 0, 0.0 2,-0.1 0, 0.0 21,-0.0 0.000 360.0 360.0 360.0-161.4 1.1 -10.4 26.5 2 192 A P - 0 0 35 0, 0.0 2,-0.2 0, 0.0 19,-0.0 -0.311 360.0-164.4 -79.3 130.4 2.5 -9.3 23.2 3 193 A K > - 0 0 136 -2,-0.1 3,-2.2 1,-0.0 12,-0.3 -0.606 40.2 -88.5-103.0 165.9 2.1 -11.4 20.0 4 194 A E T 3 S+ 0 0 173 1,-0.3 11,-0.4 -2,-0.2 -1,-0.0 0.711 119.1 55.0 -32.4 -39.1 3.8 -11.3 16.6 5 195 A S T 3 S+ 0 0 93 9,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.578 81.0 100.3 -87.0 -11.7 1.4 -8.8 15.2 6 196 A D < - 0 0 31 -3,-2.2 9,-0.5 1,-0.1 2,-0.4 -0.554 61.3-134.1 -89.7 146.0 1.4 -5.8 17.6 7 197 A R B -A 14 0A 143 -2,-0.2 23,-0.7 7,-0.1 2,-0.5 -0.715 17.0-121.6 -95.1 131.8 3.3 -2.6 17.0 8 198 A C B > -b 30 0B 0 5,-2.0 4,-1.7 -2,-0.4 23,-0.3 -0.636 23.3-142.0 -63.5 124.3 5.4 -0.8 19.6 9 199 A G T 4 S+ 0 0 41 21,-2.2 -1,-0.2 -2,-0.5 22,-0.1 0.536 94.5 48.8 -69.8 -4.4 3.7 2.5 19.7 10 200 A G T 4 S+ 0 0 49 20,-0.2 -1,-0.2 3,-0.1 21,-0.1 0.891 128.4 11.3 -96.7 -63.9 7.1 4.2 20.1 11 201 A C T 4 S- 0 0 63 2,-0.2 -2,-0.2 21,-0.0 3,-0.1 0.552 86.4-135.6 -97.5 -11.2 9.4 2.8 17.4 12 202 A G < + 0 0 36 -4,-1.7 2,-0.1 1,-0.3 -3,-0.1 0.485 60.1 135.9 69.2 -1.2 6.8 1.0 15.4 13 203 A K - 0 0 153 -6,-0.1 -5,-2.0 1,-0.1 -1,-0.3 -0.446 51.8-126.3 -71.3 155.4 9.1 -2.0 15.2 14 204 A F B A 7 0A 112 -7,-0.2 -7,-0.1 -3,-0.1 -9,-0.1 -0.447 360.0 360.0 -99.7 173.2 7.4 -5.3 15.8 15 205 A T 0 0 104 -9,-0.5 -11,-0.1 -11,-0.4 -10,-0.0 0.816 360.0 360.0 -28.2 360.0 8.3 -8.1 18.2 16 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 17 237 A N > 0 0 114 0, 0.0 3,-1.7 0, 0.0 16,-0.4 0.000 360.0 360.0 360.0 -33.8 14.9 -5.3 30.2 18 238 A D T 3 + 0 0 51 1,-0.3 16,-3.0 15,-0.2 17,-0.3 0.808 360.0 46.6 -52.2 -34.2 14.7 -2.2 27.9 19 239 A F T 3 S+ 0 0 144 14,-0.2 -1,-0.3 13,-0.2 2,-0.1 0.227 89.8 100.4-106.7 12.6 13.4 -4.5 25.2 20 240 A Q S < S- 0 0 116 -3,-1.7 13,-2.7 1,-0.1 2,-0.3 -0.420 75.3-101.0 -84.9 174.3 10.8 -6.3 27.1 21 241 A W E +C 32 0B 46 11,-0.2 2,-0.4 -2,-0.1 11,-0.2 -0.757 31.3 179.4-114.3 143.9 7.2 -5.3 26.8 22 242 A I E -C 31 0B 21 9,-2.6 9,-2.6 -2,-0.3 2,-0.4 -0.995 16.7-148.6-134.6 142.5 4.6 -3.2 28.7 23 243 A G E -C 30 0B 25 -2,-0.4 26,-0.4 7,-0.2 2,-0.4 -0.881 18.9-118.2-113.1 141.5 1.1 -2.6 27.7 24 244 A C > - 0 0 1 5,-2.4 4,-1.6 -2,-0.4 26,-0.2 -0.637 14.9-145.7 -77.3 126.3 -1.1 0.5 28.4 25 245 A D T 4 S+ 0 0 81 24,-2.7 25,-0.1 -2,-0.4 -1,-0.1 0.594 98.1 32.4 -69.8 -11.7 -4.1 -0.4 30.5 26 246 A S T 4 S+ 0 0 56 23,-0.4 -1,-0.1 3,-0.1 24,-0.1 0.805 127.2 33.3-103.7 -69.7 -6.2 2.2 28.7 27 247 A C T 4 S- 0 0 50 1,-0.1 -2,-0.1 2,-0.1 3,-0.1 0.814 86.3-147.1 -45.0 -44.6 -4.8 2.5 25.1 28 248 A Q < + 0 0 122 -4,-1.6 -1,-0.1 1,-0.3 -3,-0.1 0.354 51.3 139.2 71.6 -2.2 -4.0 -1.2 25.0 29 249 A T - 0 0 45 -6,-0.1 -5,-2.4 1,-0.1 2,-0.3 -0.427 49.0-130.2 -69.9 148.0 -1.1 -0.3 22.8 30 250 A W E -bC 8 23B 57 -23,-0.7 -21,-2.2 -7,-0.2 2,-0.3 -0.752 24.6-172.8-100.6 148.0 2.1 -2.2 23.5 31 251 A Y E - C 0 22B 12 -9,-2.6 -9,-2.6 -2,-0.3 2,-0.3 -0.985 31.0-115.0-136.2 149.5 5.6 -0.7 24.0 32 252 A H E >> - C 0 21B 13 -2,-0.3 3,-1.9 -11,-0.2 4,-1.0 -0.620 40.6-119.0 -65.6 139.0 9.2 -1.7 24.5 33 253 A F G >4 S+ 0 0 23 -13,-2.7 3,-1.0 -16,-0.4 5,-0.4 0.913 118.3 53.3 -48.0 -43.0 10.1 -0.6 28.0 34 254 A L G 34 S+ 0 0 85 -16,-3.0 -1,-0.3 1,-0.2 3,-0.2 0.696 113.5 43.0 -66.2 -18.9 12.7 1.7 26.4 35 255 A C G <4 S+ 0 0 25 -3,-1.9 -1,-0.2 -17,-0.3 -2,-0.2 0.467 92.4 84.4-104.9 -4.7 10.0 3.1 24.1 36 256 A S S << S- 0 0 2 -4,-1.0 -2,-0.1 -3,-1.0 -1,-0.1 0.533 102.3-111.2 -79.0 -10.1 7.3 3.6 26.7 37 257 A G S S+ 0 0 46 1,-0.4 2,-0.2 -4,-0.3 -3,-0.1 0.202 79.6 127.7 90.9 -13.7 8.4 6.9 28.1 38 258 A L - 0 0 24 -5,-0.4 -1,-0.4 2,-0.0 2,-0.2 -0.476 59.1-128.8 -72.9 144.3 9.4 5.2 31.3 39 259 A E >> - 0 0 34 -2,-0.2 3,-2.2 -3,-0.1 4,-0.7 -0.637 32.0-104.9 -85.2 157.4 12.8 5.6 32.9 40 260 A Q G >4 S+ 0 0 49 1,-0.3 3,-0.9 -2,-0.2 4,-0.4 0.807 118.8 58.6 -56.9 -36.9 14.7 2.4 33.8 41 261 A F G 34 S+ 0 0 12 139,-1.3 -1,-0.3 1,-0.2 3,-0.2 0.689 106.9 50.7 -67.4 -16.8 14.1 2.7 37.5 42 262 A E G X> S+ 0 0 28 -3,-2.2 3,-1.9 1,-0.2 4,-0.8 0.594 78.9 96.0 -94.4 -15.8 10.3 2.8 36.9 43 263 A Y T << S+ 0 0 18 -3,-0.9 3,-0.3 -4,-0.7 -1,-0.2 0.853 95.6 33.5 -44.0 -44.3 10.0 -0.3 34.7 44 264 A Y T 34 S+ 0 0 39 -4,-0.4 -1,-0.3 -3,-0.2 20,-0.1 0.474 103.3 78.8 -95.1 -2.3 9.0 -2.6 37.6 45 265 A L T <4 S+ 0 0 0 -3,-1.9 19,-2.1 18,-0.1 2,-0.5 0.801 74.7 77.0 -80.2 -32.3 7.1 0.0 39.6 46 266 A Y E < +D 63 0C 43 -4,-0.8 17,-0.3 -3,-0.3 3,-0.2 -0.730 39.8 178.6 -99.9 124.7 3.7 0.2 37.9 47 267 A E E S+ 0 0 112 15,-2.1 2,-0.5 -2,-0.5 16,-0.2 0.805 90.4 33.7 -82.1 -36.0 0.9 -2.4 38.2 48 268 A K E S-D 62 0C 105 14,-2.0 14,-2.4 2,-0.0 2,-0.5 -0.974 82.7-162.8-120.1 115.2 -1.3 -0.3 36.0 49 269 A F - 0 0 8 -2,-0.5 -24,-2.7 -26,-0.4 2,-0.5 -0.849 9.3-170.1-103.2 126.3 0.6 1.6 33.3 50 270 A F - 0 0 22 -2,-0.5 11,-0.3 -26,-0.2 5,-0.1 -0.974 23.8-133.6-110.9 121.8 -0.9 4.5 31.3 51 271 A C >> - 0 0 0 -2,-0.5 3,-1.9 1,-0.1 4,-1.7 -0.240 30.3 -97.5 -70.1 164.6 1.3 5.5 28.4 52 272 A P T 34 S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 578,-0.1 0.771 122.9 58.2 -58.3 -31.3 2.0 9.2 27.8 53 273 A K T 34 S+ 0 0 64 1,-0.2 4,-0.1 2,-0.1 -2,-0.0 0.736 113.6 39.9 -65.9 -23.3 -0.7 9.6 25.2 54 274 A C T X> S+ 0 0 7 -3,-1.9 4,-2.2 1,-0.1 3,-1.9 0.769 91.1 83.4-100.2 -28.0 -3.3 8.4 27.8 55 275 A V H 3X S+ 0 0 41 -4,-1.7 4,-2.5 1,-0.3 -2,-0.1 0.832 78.9 68.6 -49.4 -42.4 -2.1 10.2 31.0 56 276 A P H 34 S+ 0 0 73 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.832 119.7 20.1 -49.8 -33.6 -3.9 13.5 30.2 57 277 A H H <4 S+ 0 0 144 -3,-1.9 -2,-0.2 -4,-0.1 -3,-0.1 0.659 129.2 45.9-109.2 -17.3 -7.2 11.7 30.7 58 278 A T H < S- 0 0 42 -4,-2.2 -3,-0.2 1,-0.2 2,-0.1 0.676 97.4-133.5 -93.6 -20.4 -6.3 8.6 32.8 59 279 A G < - 0 0 34 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.1 -0.216 49.7 -28.5 78.1 175.8 -4.1 10.2 35.4 60 280 A H S S- 0 0 158 1,-0.1 -9,-0.1 -4,-0.1 -11,-0.0 -0.089 74.1 -88.8 -65.7 155.7 -0.8 8.7 36.4 61 281 A S - 0 0 23 -11,-0.3 2,-0.5 1,-0.1 -12,-0.2 -0.241 45.2-118.9 -55.0 151.4 0.2 5.1 36.3 62 282 A I E -D 48 0C 65 -14,-2.4 -15,-2.1 -3,-0.1 -14,-2.0 -0.869 23.8-138.9-103.8 123.2 -0.6 3.2 39.5 63 283 A R E -D 46 0C 81 -2,-0.5 -17,-0.3 -17,-0.3 -18,-0.1 -0.385 28.1 -93.4 -78.6 156.1 2.2 1.6 41.5 64 284 A Y - 0 0 82 -19,-2.1 2,-0.2 -20,-0.1 -1,-0.1 -0.296 46.8-105.9 -56.4 150.2 2.2 -1.8 43.1 65 285 A K - 0 0 143 10,-0.2 2,-0.8 -3,-0.1 -1,-0.1 -0.594 32.2-111.1 -77.9 143.4 1.1 -1.7 46.7 66 286 A V + 0 0 85 -2,-0.2 9,-0.2 1,-0.2 -1,-0.1 -0.700 53.0 155.5 -74.2 110.3 4.0 -2.3 49.2 67 287 A V + 0 0 43 7,-2.6 8,-0.2 -2,-0.8 -1,-0.2 0.648 68.0 34.8-111.1 -24.9 3.1 -5.7 50.6 68 288 A A > + 0 0 0 6,-2.4 3,-2.0 3,-0.1 -1,-0.2 -0.633 59.0 171.8-134.2 77.2 6.5 -7.0 51.8 69 289 A P T 3 S+ 0 0 45 0, 0.0 21,-2.1 0, 0.0 20,-0.5 0.624 80.0 59.1 -60.1 -17.2 8.6 -4.0 53.1 70 290 A H T 3 S+ 0 0 29 19,-0.2 15,-2.9 20,-0.2 2,-0.3 0.250 98.9 70.9 -97.4 9.7 11.3 -6.5 54.4 71 291 A R S < S- 0 0 26 -3,-2.0 18,-0.2 13,-0.2 3,-0.2 -0.939 79.5-128.6-127.8 149.1 11.9 -8.0 51.0 72 292 A Y S S+ 0 0 47 -2,-0.3 2,-1.7 1,-0.3 -1,-0.1 0.913 113.3 57.4 -57.2 -44.6 13.7 -6.7 47.8 73 293 A R S > S+ 0 0 104 1,-0.2 3,-1.7 2,-0.1 -1,-0.3 -0.579 72.3 165.5 -84.4 72.5 10.5 -7.7 45.9 74 294 A W T 3 + 0 0 8 -2,-1.7 -7,-2.6 1,-0.3 -6,-2.4 0.556 67.6 59.2 -72.8 -7.0 8.4 -5.5 48.1 75 295 A Y T 3 S+ 0 0 49 -9,-0.2 -1,-0.3 -8,-0.2 -10,-0.2 0.411 83.2 98.8-100.5 -2.3 5.5 -5.8 45.7 76 296 A S X - 0 0 8 -3,-1.7 3,-1.4 1,-0.2 4,-0.3 -0.799 50.8-167.5 -98.7 117.5 5.2 -9.6 45.9 77 297 A P G > S+ 0 0 87 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.851 88.6 70.4 -66.8 -32.1 2.5 -11.2 48.1 78 298 A N G 3 S+ 0 0 138 1,-0.3 3,-0.1 2,-0.1 4,-0.0 0.615 100.9 46.4 -56.6 -13.5 4.3 -14.5 47.6 79 299 A E G X S+ 0 0 29 -3,-1.4 3,-1.5 -6,-0.2 -1,-0.3 0.446 76.5 102.2-111.9 -1.8 7.2 -13.2 49.7 80 300 A K T < S+ 0 0 117 -3,-1.6 -2,-0.1 -4,-0.3 -1,-0.1 0.849 85.6 49.2 -49.1 -37.0 5.3 -11.7 52.7 81 301 A H T 3 S+ 0 0 153 -4,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.669 92.4 97.5 -83.0 -16.2 6.2 -14.7 54.8 82 302 A L S < S- 0 0 63 -3,-1.5 -12,-0.1 1,-0.1 3,-0.1 -0.047 81.3 -79.3 -72.6 174.0 9.9 -14.8 54.0 83 303 A G - 0 0 38 1,-0.1 2,-0.4 -12,-0.0 -1,-0.1 -0.208 50.7 -88.1 -74.2 161.4 12.8 -13.4 56.1 84 304 A I - 0 0 80 221,-0.1 2,-0.4 -13,-0.1 -13,-0.2 -0.555 44.6-142.3 -72.2 124.7 13.9 -9.8 56.4 85 305 A E > - 0 0 12 -15,-2.9 3,-2.2 -2,-0.4 6,-0.4 -0.722 22.3-102.5 -94.6 137.3 16.5 -9.0 53.7 86 306 A V T 3 S+ 0 0 3 218,-2.7 3,-0.1 -2,-0.4 175,-0.1 -0.342 108.1 19.5 -57.2 126.0 19.6 -6.8 54.4 87 307 A G T 3 S+ 0 0 0 1,-0.4 -1,-0.3 -2,-0.1 89,-0.3 0.252 91.2 130.5 96.7 -12.6 19.0 -3.4 52.9 88 308 A S S <> S- 0 0 0 -3,-2.2 4,-2.5 -18,-0.2 -1,-0.4 -0.301 75.8-103.8 -66.9 159.7 15.2 -3.7 52.6 89 309 A K H > S+ 0 0 68 -20,-0.5 4,-2.2 -18,-0.2 -19,-0.2 0.915 123.2 47.1 -51.5 -47.9 13.1 -0.8 54.0 90 310 A T H > S+ 0 0 44 -21,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.952 111.5 50.1 -61.2 -48.5 12.3 -2.9 57.1 91 311 A W H > S+ 0 0 15 -6,-0.4 4,-2.6 -22,-0.3 -1,-0.2 0.886 111.9 48.5 -57.8 -39.5 15.9 -4.0 57.7 92 312 A I H X S+ 0 0 3 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.904 105.8 55.0 -71.3 -42.7 17.2 -0.4 57.4 93 313 A E H < S+ 0 0 97 -4,-2.2 4,-0.5 -5,-0.2 -1,-0.2 0.873 114.9 42.2 -59.9 -35.2 14.7 1.1 59.8 94 314 A D H >X S+ 0 0 87 -4,-1.7 3,-1.4 -5,-0.2 4,-0.9 0.922 110.5 54.8 -72.8 -46.9 15.8 -1.4 62.4 95 315 A F H >X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.3 3,-0.8 0.869 99.8 62.3 -56.7 -38.2 19.6 -1.1 61.7 96 316 A I H 3< S+ 0 0 75 -4,-2.5 4,-0.3 1,-0.2 -1,-0.3 0.813 102.7 51.3 -56.8 -30.6 19.4 2.6 62.2 97 317 A T H <4 S+ 0 0 103 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.728 121.7 29.0 -82.6 -21.6 18.4 2.0 65.8 98 318 A R H X< S+ 0 0 72 -4,-0.9 3,-1.2 -3,-0.8 -2,-0.2 0.359 92.6 94.2-116.5 3.6 21.2 -0.4 66.7 99 319 A E G >< S+ 0 0 21 -4,-1.4 3,-1.8 1,-0.3 -3,-0.1 0.796 73.0 66.8 -74.8 -27.9 24.0 0.7 64.4 100 320 A N G 3 S+ 0 0 101 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.497 88.8 70.8 -71.9 0.1 25.7 3.0 66.9 101 321 A T G < + 0 0 107 -3,-1.2 -1,-0.3 2,-0.1 -2,-0.2 0.404 68.6 108.8 -95.4 -0.6 26.6 -0.1 68.9 102 322 A V S < S- 0 0 22 -3,-1.8 216,-0.2 1,-0.1 215,-0.1 -0.644 83.6-102.4 -71.1 132.7 29.1 -1.3 66.3 103 323 A P - 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