ID 4WW2A STANDARD; PRT; 207 AA. DT CONVERTED FROM PDB (SEQRES) 4WW2 DE TCR Alpha Chain-TRAV21-TRAJ8 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.480 CC R-Factor 0.198 FT #SUB 32 31 TYR A 99 110 ASP B Protein S 6 FT #SUB 33 32 ASN A 99 110 ASP B Protein S 1 FT #SUB 35 40 GLN A 100 111 LEU B Protein S 1 FT #SUB 35 40 GLN A 101 112 GLU B Protein S 3 FT #SUB 35 40 GLN A 102 113 GLN B Protein S 4 FT #SUB 37 42 PHE A 102 113 GLN B Protein S 1 FT #SUB 37 42 PHE A 104 115 PHE B Protein S 3 FT #SUB 39 44 GLN A 38 44 GLN B Protein S 9 FT #SUB 41 46 PRO A 173 184 PRO B Protein S 1 FT #SUB 42 47 GLY A 90 101 VAL B Protein B 1 FT #SUB 43 48 LYS A 10 9 ARG B Protein S 6 FT #SUB 43 48 LYS A 11 10 TYR B Protein S 2 FT #SUB 43 48 LYS A 90 101 VAL B Protein S 2 FT #SUB 43 48 LYS A 106 117 PRO B Protein S 4 FT #SUB 43 48 LYS A 107 118 GLY B Protein S 2 FT #SUB 43 48 LYS A 109 120 ARG B Protein S 4 FT #SUB 44 49 GLY A 106 117 PRO B Protein B 1 FT #SUB 45 50 LEU A 104 115 PHE B Protein A 10 FT #SUB 50 55 LEU A 101 112 GLU B Protein S 3 FT #SUB 90 103 LEU A 44 50 PRO B Protein S 1 FT #SUB 94 107 VAL A 102 113 GLN B Protein S 1 FT #SUB 98 111 PHE A 100 111 LEU B Protein B 1 FT #SUB 99 112 GLN A 34 40 PHE B Protein A 4 FT #SUB 99 112 GLN A 49 55 TYR B Protein S 5 FT #SUB 99 112 GLN A 100 111 LEU B Protein B 1 FT #SUB 99 112 GLN A 102 113 GLN B Protein B 1 FT #SUB 100 113 LYS A 36 42 TYR B Protein B 2 FT #SUB 100 113 LYS A 46 52 PHE B Protein S 7 FT #SUB 100 113 LYS A 59 69 SER B Protein S 1 FT #SUB 101 114 LEU A 36 42 TYR B Protein A 7 FT #SUB 101 114 LEU A 102 113 GLN B Protein S 6 FT #SUB 101 114 LEU A 104 115 PHE B Protein S 2 FT #SUB 103 116 PHE A 44 50 PRO B Protein S 7 FT #SUB 103 116 PHE A 104 115 PHE B Protein S 1 FT #SUB 104 117 GLY A 43 49 GLY B Protein B 1 FT #SUB 105 118 THR A 42 48 GLN B Protein S 2 FT #SUB 105 118 THR A 43 49 GLY B Protein B 1 FT #SUB 119 132 ASP A 136 147 HIS B Protein S 7 FT #SUB 119 132 ASP A 137 148 THR B Protein S 1 FT #SUB 123 136 TYR A 130 141 SER B Protein S 1 FT #SUB 123 136 TYR A 132 143 ALA B Protein S 1 FT #SUB 123 136 TYR A 133 144 GLU B Protein S 12 FT #SUB 123 136 TYR A 136 147 HIS B Protein S 2 FT #SUB 123 136 TYR A 137 148 THR B Protein S 1 FT #SUB 124 137 GLN A 130 141 SER B Protein B 2 FT #SUB 125 138 LEU A 127 138 PHE B Protein A 3 FT #SUB 125 138 LEU A 128 139 GLU B Protein A 4 FT #SUB 125 138 LEU A 141 152 THR B Protein S 1 FT #SUB 125 138 LEU A 143 154 VAL B Protein S 1 FT #SUB 126 139 ARG A 127 138 PHE B Protein B 3 FT #SUB 126 139 ARG A 128 139 GLU B Protein B 3 FT #SUB 127 140 ASP A 125 136 ALA B Protein S 1 FT #SUB 127 140 ASP A 126 137 VAL B Protein A 4 FT #SUB 127 140 ASP A 127 138 PHE B Protein A 6 FT #SUB 128 141 SER A 126 137 VAL B Protein A 4 FT #SUB 128 141 SER A 128 139 GLU B Protein A 2 FT #SUB 128 141 SER A 237 248 GLU B Protein S 2 FT #SUB 133 146 LYS A 127 138 PHE B Protein B 1 FT #SUB 134 147 SER A 127 138 PHE B Protein B 4 FT #SUB 135 148 VAL A 127 138 PHE B Protein A 7 FT #SUB 135 148 VAL A 143 154 VAL B Protein S 1 FT #SUB 135 148 VAL A 145 156 LEU B Protein S 1 FT #SUB 137 150 LEU A 141 152 THR B Protein S 2 FT #SUB 137 150 LEU A 192 203 ARG B Protein S 1 FT #SUB 140 153 ASP A 137 148 THR B Protein S 1 FT #SUB 140 153 ASP A 194 205 ARG B Protein S 7 FT #SUB 156 169 TYR A 178 189 GLU B Protein S 5 FT #SUB 157 170 ILE A 176 187 LEU B Protein B 2 FT #SUB 158 171 THR A 172 183 ASP B Protein S 5 FT #SUB 158 171 THR A 176 187 LEU B Protein S 1 FT #SUB 158 171 THR A 190 201 SER B Protein S 1 FT #SUB 158 171 THR A 192 203 ARG B Protein S 1 FT #SUB 159 172 ASP A 192 203 ARG B Protein B 1 FT #SUB 161 174 CYS A 170 181 CYS B Protein A 8 FT #SUB 161 174 CYS A 171 182 THR B Protein S 3 FT #SUB 161 174 CYS A 192 203 ARG B Protein A 3 FT #SUB 162 175 VAL A 170 181 CYS B Protein B 6 FT #SUB 163 176 LEU A 168 179 GLY B Protein S 3 FT #SUB 163 176 LEU A 169 180 VAL B Protein A 3 FT #SUB 163 176 LEU A 170 181 CYS B Protein S 1 FT #SUB 163 176 LEU A 194 205 ARG B Protein S 3 FT #SUB 164 177 ASP A 167 178 SER B Protein B 2 FT #SUB 164 177 ASP A 168 179 GLY B Protein B 3 FT #SUB 165 178 MET A 139 150 LYS B Protein S 3 FT #SUB 165 178 MET A 194 205 ARG B Protein S 1 FT #SUB 165 178 MET A 195 206 VAL B Protein S 1 FT #SUB 165 178 MET A 196 207 SER B Protein S 1 FT #SUB 166 179 ARG A 166 177 HIS B Protein S 1 FT #SUB 166 179 ARG A 167 178 SER B Protein A 3 FT #SUB 168 181 MET A 139 150 LYS B Protein S 2 FT #SUB 170 183 PHE A 139 150 LYS B Protein S 12 FT #SUB 170 183 PHE A 194 205 ARG B Protein S 2 FT #SUB 172 185 SER A 194 205 ARG B Protein S 2 FT #SUB 174 187 SER A 192 203 ARG B Protein A 8 FT #SUB 175 188 ALA A 192 203 ARG B Protein B 2 FT #SUB 176 189 VAL A 192 203 ARG B Protein S 3 FT #SUB 178 191 TRP A 145 156 LEU B Protein S 6 FT #SUB 178 191 TRP A 176 187 LEU B Protein S 1 FT #SUB 178 191 TRP A 188 199 ALA B Protein S 1 FT #SUB 202 215 PRO A 132 143 ALA B Protein S 2 FT #SUB 1 0 MET A 62 61 GLN C Protein B 9 FT #SUB 1 0 MET A 63 62 GLN C Protein B 1 FT #SUB 2 1 LYS A 62 61 GLN C Protein B 4 FT #SUB 30 29 ALA A 161 160 TRP C Protein S 1 FT #SUB 32 31 TYR A 154 153 TRP C Protein S 11 FT #SUB 32 31 TYR A 157 156 GLU C Protein S 4 FT #SUB 53 58 SER A 157 156 GLU C Protein S 4 FT #SUB 96 109 THR A 154 153 TRP C Protein B 4 FT #SUB 96 109 THR A 157 156 GLU C Protein S 2 FT #SUB 96 109 THR A 158 157 THR C Protein A 4 FT #SUB 96 109 THR A 161 160 TRP C Protein S 2 FT #SUB 97 110 GLY A 69 68 HIS C Protein B 1 FT #SUB 97 110 GLY A 70 69 ILE C Protein B 1 FT #SUB 97 110 GLY A 154 153 TRP C Protein B 3 FT #SUB 97 110 GLY A 158 157 THR C Protein B 1 FT #SUB 98 111 PHE A 66 65 THR C Protein S 2 FT #SUB 98 111 PHE A 69 68 HIS C Protein S 2 FT #SUB 98 111 PHE A 154 153 TRP C Protein B 4 FT #SUB 99 112 GLN A 69 68 HIS C Protein S 3 FT #SUB 99 112 GLN A 73 72 VAL C Protein S 2 FT #SUB 99 112 GLN A 154 153 TRP C Protein S 2 FT #HET 99 112 GLN A 3 303 JLS C S 5 FT DISORDER 204 207 CC SEQUENCE 203 AA (ATOM); CC MKQEVTQIPA ALSVPEGENL VLNCSFTDSA IYNLQWFRQD PGKGLTSLLL IQSSQREQTS CC GRLNASLDKS SGRSTLYIAA SQPGDSATYL CAGVNTGFQK LVFGTGTRLL VSPNIQNPDP CC AVYQLRDSKS SDKSVCLFTD FDSQTNVSQS KDSDVYITDK CVLDMRSMDF KSNSAVAWSN CC KSDFACANAF NNSIIPEDTF FPS CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKQEVTQIPAALSVPEGENLVLNCSFTDSAIYNLQWFRQDPGKGLTSLLL CC ATOM MKQEVTQIPAALSVPEGENLVLNCSFTDSAIYNLQWFRQDPGKGLTSLLL CC ************************************************** CC SEQRES IQSSQREQTSGRLNASLDKSSGRSTLYIAASQPGDSATYLCAGVNTGFQK CC ATOM IQSSQREQTSGRLNASLDKSSGRSTLYIAASQPGDSATYLCAGVNTGFQK CC ************************************************** CC SEQRES LVFGTGTRLLVSPNIQNPDPAVYQLRDSKSSDKSVCLFTDFDSQTNVSQS CC ATOM LVFGTGTRLLVSPNIQNPDPAVYQLRDSKSSDKSVCLFTDFDSQTNVSQS CC ************************************************** CC SEQRES KDSDVYITDKCVLDMRSMDFKSNSAVAWSNKSDFACANAFNNSIIPEDTF CC ATOM KDSDVYITDKCVLDMRSMDFKSNSAVAWSNKSDFACANAFNNSIIPEDTF CC ************************************************** CC SEQRES FPSPESS CC ATOM FPS---- CC *** SQ SEQUENCE 207 AA; MW; CN; MKQEVTQIPA ALSVPEGENL VLNCSFTDSA IYNLQWFRQD PGKGLTSLLL IQSSQREQTS GRLNASLDKS SGRSTLYIAA SQPGDSATYL CAGVNTGFQK LVFGTGTRLL VSPNIQNPDP AVYQLRDSKS SDKSVCLFTD FDSQTNVSQS KDSDVYITDK CVLDMRSMDF KSNSAVAWSN KSDFACANAF NNSIIPEDTF FPSPESS // ID 4WW2B STANDARD; PRT; 243 AA. DT CONVERTED FROM PDB (SEQRES) 4WW2 DE TCR Beta Chain-TRBV7-8 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.480 CC R-Factor 0.198 FT #SUB 10 9 ARG B 43 48 LYS A Protein A 6 FT #SUB 11 10 TYR B 43 48 LYS A Protein S 2 FT #SUB 34 40 PHE B 99 112 GLN A Protein S 4 FT #SUB 36 42 TYR B 100 113 LYS A Protein S 2 FT #SUB 36 42 TYR B 101 114 LEU A Protein S 7 FT #SUB 38 44 GLN B 39 44 GLN A Protein S 9 FT #SUB 42 48 GLN B 105 118 THR A Protein S 2 FT #SUB 43 49 GLY B 104 117 GLY A Protein B 1 FT #SUB 43 49 GLY B 105 118 THR A Protein B 1 FT #SUB 44 50 PRO B 90 103 LEU A Protein S 1 FT #SUB 44 50 PRO B 103 116 PHE A Protein A 7 FT #SUB 46 52 PHE B 100 113 LYS A Protein S 7 FT #SUB 49 55 TYR B 99 112 GLN A Protein S 5 FT #SUB 59 69 SER B 100 113 LYS A Protein S 1 FT #SUB 90 101 VAL B 42 47 GLY A Protein S 1 FT #SUB 90 101 VAL B 43 48 LYS A Protein S 2 FT #SUB 99 110 ASP B 32 31 TYR A Protein B 6 FT #SUB 99 110 ASP B 33 32 ASN A Protein B 1 FT #SUB 100 111 LEU B 35 40 GLN A Protein B 1 FT #SUB 100 111 LEU B 98 111 PHE A Protein S 1 FT #SUB 100 111 LEU B 99 112 GLN A Protein S 1 FT #SUB 101 112 GLU B 35 40 GLN A Protein B 3 FT #SUB 101 112 GLU B 50 55 LEU A Protein A 3 FT #SUB 102 113 GLN B 35 40 GLN A Protein B 4 FT #SUB 102 113 GLN B 37 42 PHE A Protein B 1 FT #SUB 102 113 GLN B 94 107 VAL A Protein S 1 FT #SUB 102 113 GLN B 99 112 GLN A Protein S 1 FT #SUB 102 113 GLN B 101 114 LEU A Protein S 6 FT #SUB 104 115 PHE B 37 42 PHE A Protein S 3 FT #SUB 104 115 PHE B 45 50 LEU A Protein S 10 FT #SUB 104 115 PHE B 101 114 LEU A Protein S 2 FT #SUB 104 115 PHE B 103 116 PHE A Protein S 1 FT #SUB 106 117 PRO B 43 48 LYS A Protein B 4 FT #SUB 106 117 PRO B 44 49 GLY A Protein B 1 FT #SUB 107 118 GLY B 43 48 LYS A Protein B 2 FT #SUB 109 120 ARG B 43 48 LYS A Protein A 4 FT #SUB 125 136 ALA B 127 140 ASP A Protein S 1 FT #SUB 126 137 VAL B 127 140 ASP A Protein B 4 FT #SUB 126 137 VAL B 128 141 SER A Protein B 4 FT #SUB 127 138 PHE B 125 138 LEU A Protein A 3 FT #SUB 127 138 PHE B 126 139 ARG A Protein A 3 FT #SUB 127 138 PHE B 127 140 ASP A Protein S 6 FT #SUB 127 138 PHE B 133 146 LYS A Protein S 1 FT #SUB 127 138 PHE B 134 147 SER A Protein S 4 FT #SUB 127 138 PHE B 135 148 VAL A Protein S 7 FT #SUB 128 139 GLU B 125 138 LEU A Protein B 4 FT #SUB 128 139 GLU B 126 139 ARG A Protein A 3 FT #SUB 128 139 GLU B 128 141 SER A Protein S 2 FT #SUB 130 141 SER B 123 136 TYR A Protein S 1 FT #SUB 130 141 SER B 124 137 GLN A Protein S 2 FT #SUB 132 143 ALA B 123 136 TYR A Protein B 1 FT #SUB 132 143 ALA B 202 215 PRO A Protein S 2 FT #SUB 133 144 GLU B 123 136 TYR A Protein A 12 FT #SUB 136 147 HIS B 119 132 ASP A Protein S 7 FT #SUB 136 147 HIS B 123 136 TYR A Protein S 2 FT #SUB 137 148 THR B 119 132 ASP A Protein S 1 FT #SUB 137 148 THR B 123 136 TYR A Protein S 1 FT #SUB 137 148 THR B 140 153 ASP A Protein S 1 FT #SUB 139 150 LYS B 165 178 MET A Protein S 3 FT #SUB 139 150 LYS B 168 181 MET A Protein S 2 FT #SUB 139 150 LYS B 170 183 PHE A Protein S 12 FT #SUB 141 152 THR B 125 138 LEU A Protein B 1 FT #SUB 141 152 THR B 137 150 LEU A Protein S 2 FT #SUB 143 154 VAL B 125 138 LEU A Protein S 1 FT #SUB 143 154 VAL B 135 148 VAL A Protein S 1 FT #SUB 145 156 LEU B 135 148 VAL A Protein S 1 FT #SUB 145 156 LEU B 178 191 TRP A Protein S 6 FT #SUB 166 177 HIS B 166 179 ARG A Protein B 1 FT #SUB 167 178 SER B 164 177 ASP A Protein A 2 FT #SUB 167 178 SER B 166 179 ARG A Protein A 3 FT #SUB 168 179 GLY B 163 176 LEU A Protein B 3 FT #SUB 168 179 GLY B 164 177 ASP A Protein B 3 FT #SUB 169 180 VAL B 163 176 LEU A Protein B 3 FT #SUB 170 181 CYS B 161 174 CYS A Protein A 8 FT #SUB 170 181 CYS B 162 175 VAL A Protein S 6 FT #SUB 170 181 CYS B 163 176 LEU A Protein S 1 FT #SUB 171 182 THR B 161 174 CYS A Protein B 3 FT #SUB 172 183 ASP B 158 171 THR A Protein S 5 FT #SUB 173 184 PRO B 41 46 PRO A Protein B 1 FT #SUB 176 187 LEU B 157 170 ILE A Protein S 2 FT #SUB 176 187 LEU B 158 171 THR A Protein S 1 FT #SUB 176 187 LEU B 178 191 TRP A Protein S 1 FT #SUB 178 189 GLU B 156 169 TYR A Protein B 5 FT #SUB 188 199 ALA B 178 191 TRP A Protein S 1 FT #SUB 190 201 SER B 158 171 THR A Protein S 1 FT #SUB 192 203 ARG B 137 150 LEU A Protein S 1 FT #SUB 192 203 ARG B 158 171 THR A Protein S 1 FT #SUB 192 203 ARG B 159 172 ASP A Protein S 1 FT #SUB 192 203 ARG B 161 174 CYS A Protein S 3 FT #SUB 192 203 ARG B 174 187 SER A Protein S 8 FT #SUB 192 203 ARG B 175 188 ALA A Protein S 2 FT #SUB 192 203 ARG B 176 189 VAL A Protein S 3 FT #SUB 194 205 ARG B 140 153 ASP A Protein S 7 FT #SUB 194 205 ARG B 163 176 LEU A Protein S 3 FT #SUB 194 205 ARG B 165 178 MET A Protein S 1 FT #SUB 194 205 ARG B 170 183 PHE A Protein S 2 FT #SUB 194 205 ARG B 172 185 SER A Protein S 2 FT #SUB 195 206 VAL B 165 178 MET A Protein B 1 FT #SUB 196 207 SER B 165 178 MET A Protein B 1 FT #SUB 237 248 GLU B 128 141 SER A Protein B 2 FT #SUB 31 30 VAL B 80 79 ARG C Protein S 1 FT #SUB 51 57 GLN B 77 76 SER C Protein S 1 FT #SUB 51 57 GLN B 80 79 ARG C Protein S 4 FT #SUB 52 58 ASN B 80 79 ARG C Protein S 4 FT #SUB 56 66 LEU B 69 68 HIS C Protein B 2 FT #SUB 56 66 LEU B 76 75 SER C Protein S 1 FT #SUB 57 67 ASP B 69 68 HIS C Protein S 4 FT #SUB 100 111 LEU B 154 153 TRP C Protein S 2 FT #HET 49 55 TYR B 3 303 JLS C S 2 FT #HET 51 57 GLN B 3 303 JLS C S 7 FT #HET 98 109 ARG B 3 303 JLS C A 17 FT #HET 100 111 LEU B 3 303 JLS C S 2 CC SEQUENCE 243 AA (ATOM); CC MGAGVSQSPR YKVAKRGQDV ALRCDPISGH VSLFWYQQAL GQGPEFLTYF QNEAQLDKSG CC LPSDRFFAER PEGSVSTLKI QRTQQEDSAV YLCASSSRDL EQYFGPGTRL TVTEDLKNVF CC PPEVAVFEPS EAEISHTQKA TLVCLATGFY PDHVELSWWV NGKEVHSGVC TDPQPLKEQP CC ALNDSRYALS SRLRVSATFW QNPRNHFRCQ VQFYGLSEND EWTQDRAKPV TQIVSAEAWG CC RAD CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MGAGVSQSPRYKVAKRGQDVALRCDPISGHVSLFWYQQALGQGPEFLTYF CC ATOM MGAGVSQSPRYKVAKRGQDVALRCDPISGHVSLFWYQQALGQGPEFLTYF CC ************************************************** CC SEQRES QNEAQLDKSGLPSDRFFAERPEGSVSTLKIQRTQQEDSAVYLCASSSRDL CC ATOM QNEAQLDKSGLPSDRFFAERPEGSVSTLKIQRTQQEDSAVYLCASSSRDL CC ************************************************** CC SEQRES EQYFGPGTRLTVTEDLKNVFPPEVAVFEPSEAEISHTQKATLVCLATGFY CC ATOM EQYFGPGTRLTVTEDLKNVFPPEVAVFEPSEAEISHTQKATLVCLATGFY CC ************************************************** CC SEQRES PDHVELSWWVNGKEVHSGVCTDPQPLKEQPALNDSRYALSSRLRVSATFW CC ATOM PDHVELSWWVNGKEVHSGVCTDPQPLKEQPALNDSRYALSSRLRVSATFW CC ************************************************** CC SEQRES QNPRNHFRCQVQFYGLSENDEWTQDRAKPVTQIVSAEAWGRAD CC ATOM QNPRNHFRCQVQFYGLSENDEWTQDRAKPVTQIVSAEAWGRAD CC ******************************************* SQ SEQUENCE 243 AA; MW; CN; MGAGVSQSPR YKVAKRGQDV ALRCDPISGH VSLFWYQQAL GQGPEFLTYF QNEAQLDKSG LPSDRFFAER PEGSVSTLKI QRTQQEDSAV YLCASSSRDL EQYFGPGTRL TVTEDLKNVF PPEVAVFEPS EAEISHTQKA TLVCLATGFY PDHVELSWWV NGKEVHSGVC TDPQPLKEQP ALNDSRYALS SRLRVSATFW QNPRNHFRCQ VQFYGLSEND EWTQDRAKPV TQIVSAEAWG RAD // ID 4WW2C STANDARD; PRT; 284 AA. DT CONVERTED FROM PDB (SEQRES) 4WW2 DE Antigen-presenting glycoprotein CD1d OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.480 CC R-Factor 0.198 FT #SUB 62 61 GLN C 1 0 MET A Protein S 9 FT #SUB 62 61 GLN C 2 1 LYS A Protein S 4 FT #SUB 63 62 GLN C 1 0 MET A Protein S 1 FT #SUB 66 65 THR C 98 111 PHE A Protein S 2 FT #SUB 69 68 HIS C 97 110 GLY A Protein S 1 FT #SUB 69 68 HIS C 98 111 PHE A Protein S 2 FT #SUB 69 68 HIS C 99 112 GLN A Protein S 3 FT #SUB 70 69 ILE C 97 110 GLY A Protein S 1 FT #SUB 73 72 VAL C 99 112 GLN A Protein S 2 FT #SUB 154 153 TRP C 32 31 TYR A Protein A 11 FT #SUB 154 153 TRP C 96 109 THR A Protein S 4 FT #SUB 154 153 TRP C 97 110 GLY A Protein S 3 FT #SUB 154 153 TRP C 98 111 PHE A Protein S 4 FT #SUB 154 153 TRP C 99 112 GLN A Protein S 2 FT #SUB 157 156 GLU C 32 31 TYR A Protein S 4 FT #SUB 157 156 GLU C 53 58 SER A Protein S 4 FT #SUB 157 156 GLU C 96 109 THR A Protein B 2 FT #SUB 158 157 THR C 96 109 THR A Protein A 4 FT #SUB 158 157 THR C 97 110 GLY A Protein S 1 FT #SUB 161 160 TRP C 30 29 ALA A Protein S 1 FT #SUB 161 160 TRP C 96 109 THR A Protein S 2 FT #SUB 69 68 HIS C 56 66 LEU B Protein S 2 FT #SUB 69 68 HIS C 57 67 ASP B Protein S 4 FT #SUB 76 75 SER C 56 66 LEU B Protein S 1 FT #SUB 77 76 SER C 51 57 GLN B Protein S 1 FT #SUB 80 79 ARG C 31 30 VAL B Protein S 1 FT #SUB 80 79 ARG C 51 57 GLN B Protein S 4 FT #SUB 80 79 ARG C 52 58 ASN B Protein S 4 FT #SUB 154 153 TRP C 100 111 LEU B Protein S 2 FT #SUB 14 13 LEU C 55 55 SER F Protein S 1 FT #SUB 14 13 LEU C 56 56 PHE F Protein S 5 FT #SUB 15 14 GLN C 56 56 PHE F Protein B 2 FT #SUB 16 15 ILE C 54 54 LEU F Protein S 4 FT #SUB 16 15 ILE C 56 56 PHE F Protein S 2 FT #SUB 16 15 ILE C 62 62 PHE F Protein S 1 FT #SUB 30 29 LEU C 54 54 LEU F Protein S 1 FT #SUB 30 29 LEU C 55 55 SER F Protein S 1 FT #SUB 32 31 TRP C 55 55 SER F Protein S 1 FT #SUB 32 31 TRP C 63 63 TYR F Protein S 3 FT #SUB 37 36 GLN C 53 53 ASP F Protein S 1 FT #SUB 40 39 SER C 53 53 ASP F Protein S 3 FT #SUB 96 95 GLU C 32 32 PRO F Protein S 3 FT #SUB 96 95 GLU C 33 33 SER F Protein S 6 FT #SUB 96 95 GLU C 62 62 PHE F Protein S 2 FT #SUB 98 97 GLN C 31 31 HIS F Protein S 4 FT #SUB 98 97 GLN C 56 56 PHE F Protein S 6 FT #SUB 98 97 GLN C 60 60 TRP F Protein A 11 FT #SUB 98 97 GLN C 62 62 PHE F Protein S 5 FT #SUB 99 98 VAL C 56 56 PHE F Protein B 1 FT #SUB 100 99 SER C 60 60 TRP F Protein S 1 FT #SUB 116 115 HIS C 60 60 TRP F Protein A 4 FT #SUB 118 117 ALA C 60 60 TRP F Protein S 7 FT #SUB 120 119 GLN C 31 31 HIS F Protein B 1 FT #SUB 121 120 GLY C 31 31 HIS F Protein B 4 FT #SUB 121 120 GLY C 60 60 TRP F Protein B 3 FT #SUB 123 122 ASP C 60 60 TRP F Protein S 5 FT #SUB 210 209 SER C 12 12 ARG F Protein S 1 FT #SUB 211 210 GLY C 12 12 ARG F Protein B 2 FT #SUB 235 234 ASP C 6 6 LYS F Protein S 4 FT #SUB 235 234 ASP C 8 8 GLN F Protein S 1 FT #SUB 237 236 LEU C 8 8 GLN F Protein S 3 FT #SUB 237 236 LEU C 10 10 TYR F Protein A 7 FT #SUB 237 236 LEU C 26 26 TYR F Protein S 1 FT #SUB 238 237 PRO C 10 10 TYR F Protein A 8 FT #SUB 238 237 PRO C 24 24 ASN F Protein B 1 FT #SUB 238 237 PRO C 26 26 TYR F Protein S 5 FT #SUB 238 237 PRO C 65 65 LEU F Protein B 2 FT #SUB 239 238 ASN C 10 10 TYR F Protein S 1 FT #SUB 239 238 ASN C 12 12 ARG F Protein S 5 FT #SUB 239 238 ASN C 24 24 ASN F Protein S 1 FT #SUB 239 238 ASN C 65 65 LEU F Protein B 1 FT #SUB 240 239 ALA C 65 65 LEU F Protein B 2 FT #SUB 240 239 ALA C 67 67 TYR F Protein S 6 FT #SUB 241 240 ASP C 12 12 ARG F Protein S 7 FT #SUB 243 242 THR C 12 12 ARG F Protein S 5 FT #HET 13 12 CYS C 3 303 JLS C A 4 FT #HET 14 13 LEU C 3 303 JLS C B 4 FT #HET 15 14 GLN C 3 303 JLS C S 3 FT #HET 20 19 ALA C 1 301 NAG C S 2 FT #HET 24 23 TRP C 1 301 NAG C S 2 FT #HET 24 23 TRP C 2 302 NAG C S 3 FT #HET 25 24 THR C 2 302 NAG C B 7 FT #HET 26 25 ARG C 2 302 NAG C S 2 FT #HET 30 29 LEU C 3 303 JLS C B 2 FT #HET 31 30 ALA C 3 303 JLS C S 1 FT #HET 41 40 TRP C 3 303 JLS C S 2 FT #HET 48 47 VAL C 3 303 JLS C S 2 FT #HET 64 63 TRP C 3 303 JLS C S 1 FT #HET 71 70 PHE C 3 303 JLS C S 6 FT #HET 73 72 VAL C 3 303 JLS C S 1 FT #HET 74 73 TYR C 3 303 JLS C A 10 FT #HET 77 76 SER C 3 303 JLS C S 4 FT #HET 78 77 PHE C 3 303 JLS C S 2 FT #HET 80 79 ARG C 3 303 JLS C S 1 FT #HET 81 80 ASP C 3 303 JLS C S 7 FT #HET 82 81 VAL C 3 303 JLS C A 2 FT #HET 85 84 PHE C 3 303 JLS C S 3 FT #HET 91 90 LEU C 3 303 JLS C S 2 FT #HET 97 96 LEU C 3 303 JLS C S 1 FT #HET 115 114 PHE C 3 303 JLS C S 1 FT #HET 117 116 VAL C 3 303 JLS C S 1 FT #HET 132 131 TRP C 3 303 JLS C S 2 FT #HET 141 140 TRP C 3 303 JLS C S 2 FT #HET 149 148 LEU C 3 303 JLS C S 1 FT #HET 152 151 ASP C 3 303 JLS C S 11 FT #HET 154 153 TRP C 3 303 JLS C S 17 FT #HET 155 154 THR C 3 303 JLS C S 11 FT #HET 158 157 THR C 3 303 JLS C S 1 FT #HET 159 158 VAL C 3 303 JLS C S 1 FT #HET 162 161 LEU C 3 303 JLS C S 2 FT #HET 170 169 PHE C 3 303 JLS C S 3 FT #MOD 21 20 ASN C 1 301 NAG C S FT #MOD 43 42 ASN C 2 302 NAG C S FT DISORDER 1 3 FT DISORDER 279 284 CC SEQUENCE 275 AA (ATOM); CC VPQRLFPLRC LQISSFANSS WTRTDGLAWL GELQTHSWSN DSDTVRSLKP WSQGTFSDQQ CC WETLQHIFRV YRSSFTRDVK EFAKMLRLSY PLELQVSAGC EVHPGNASNN FFHVAFQGKD CC ILSFQGTSWE PTQEAPLWVN LAIQVLNQDK WTRETVQWLL NGTCPQFVSG LLESGKSELK CC KQVKPKAWLS RGPSPGPGRL LLVCHVSGFY PKPVWVKWMR GEQEQQGTQP GDILPNADET CC WYLRATLDVV AGEAAGLSCR VKHSSLEGQD IVLYW CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES SPGVPQRLFPLRCLQISSFANSSWTRTDGLAWLGELQTHSWSNDSDTVRS CC ATOM ---VPQRLFPLRCLQISSFANSSWTRTDGLAWLGELQTHSWSNDSDTVRS CC *********************************************** CC SEQRES LKPWSQGTFSDQQWETLQHIFRVYRSSFTRDVKEFAKMLRLSYPLELQVS CC ATOM LKPWSQGTFSDQQWETLQHIFRVYRSSFTRDVKEFAKMLRLSYPLELQVS CC ************************************************** CC SEQRES AGCEVHPGNASNNFFHVAFQGKDILSFQGTSWEPTQEAPLWVNLAIQVLN CC ATOM AGCEVHPGNASNNFFHVAFQGKDILSFQGTSWEPTQEAPLWVNLAIQVLN CC ************************************************** CC SEQRES QDKWTRETVQWLLNGTCPQFVSGLLESGKSELKKQVKPKAWLSRGPSPGP CC ATOM QDKWTRETVQWLLNGTCPQFVSGLLESGKSELKKQVKPKAWLSRGPSPGP CC ************************************************** CC SEQRES GRLLLVCHVSGFYPKPVWVKWMRGEQEQQGTQPGDILPNADETWYLRATL CC ATOM GRLLLVCHVSGFYPKPVWVKWMRGEQEQQGTQPGDILPNADETWYLRATL CC ************************************************** CC SEQRES DVVAGEAAGLSCRVKHSSLEGQDIVLYWHHHHHH CC ATOM DVVAGEAAGLSCRVKHSSLEGQDIVLYW------ CC **************************** SQ SEQUENCE 284 AA; MW; CN; SPGVPQRLFP LRCLQISSFA NSSWTRTDGL AWLGELQTHS WSNDSDTVRS LKPWSQGTFS DQQWETLQHI FRVYRSSFTR DVKEFAKMLR LSYPLELQVS AGCEVHPGNA SNNFFHVAFQ GKDILSFQGT SWEPTQEAPL WVNLAIQVLN QDKWTRETVQ WLLNGTCPQF VSGLLESGKS ELKKQVKPKA WLSRGPSPGP GRLLLVCHVS GFYPKPVWVK WMRGEQEQQG TQPGDILPNA DETWYLRATL DVVAGEAAGL SCRVKHSSLE GQDIVLYWHH HHHH // ID 4WW2F STANDARD; PRT; 99 AA. DT CONVERTED FROM PDB (SEQRES) 4WW2 DE Beta-2-microglobulin OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.480 CC R-Factor 0.198 FT #SUB 6 6 LYS F 235 234 ASP C Protein S 4 FT #SUB 8 8 GLN F 235 234 ASP C Protein S 1 FT #SUB 8 8 GLN F 237 236 LEU C Protein S 3 FT #SUB 10 10 TYR F 237 236 LEU C Protein S 7 FT #SUB 10 10 TYR F 238 237 PRO C Protein S 8 FT #SUB 10 10 TYR F 239 238 ASN C Protein S 1 FT #SUB 12 12 ARG F 210 209 SER C Protein B 1 FT #SUB 12 12 ARG F 211 210 GLY C Protein S 2 FT #SUB 12 12 ARG F 239 238 ASN C Protein S 5 FT #SUB 12 12 ARG F 241 240 ASP C Protein S 7 FT #SUB 12 12 ARG F 243 242 THR C Protein S 5 FT #SUB 24 24 ASN F 238 237 PRO C Protein S 1 FT #SUB 24 24 ASN F 239 238 ASN C Protein S 1 FT #SUB 26 26 TYR F 237 236 LEU C Protein S 1 FT #SUB 26 26 TYR F 238 237 PRO C Protein S 5 FT #SUB 31 31 HIS F 98 97 GLN C Protein S 4 FT #SUB 31 31 HIS F 120 119 GLN C Protein S 1 FT #SUB 31 31 HIS F 121 120 GLY C Protein S 4 FT #SUB 32 32 PRO F 96 95 GLU C Protein A 3 FT #SUB 33 33 SER F 96 95 GLU C Protein A 6 FT #SUB 53 53 ASP F 37 36 GLN C Protein S 1 FT #SUB 53 53 ASP F 40 39 SER C Protein S 3 FT #SUB 54 54 LEU F 16 15 ILE C Protein A 4 FT #SUB 54 54 LEU F 30 29 LEU C Protein B 1 FT #SUB 55 55 SER F 14 13 LEU C Protein S 1 FT #SUB 55 55 SER F 30 29 LEU C Protein S 1 FT #SUB 55 55 SER F 32 31 TRP C Protein S 1 FT #SUB 56 56 PHE F 14 13 LEU C Protein A 5 FT #SUB 56 56 PHE F 15 14 GLN C Protein S 2 FT #SUB 56 56 PHE F 16 15 ILE C Protein S 2 FT #SUB 56 56 PHE F 98 97 GLN C Protein S 6 FT #SUB 56 56 PHE F 99 98 VAL C Protein S 1 FT #SUB 60 60 TRP F 98 97 GLN C Protein A 11 FT #SUB 60 60 TRP F 100 99 SER C Protein S 1 FT #SUB 60 60 TRP F 116 115 HIS C Protein S 4 FT #SUB 60 60 TRP F 118 117 ALA C Protein S 7 FT #SUB 60 60 TRP F 121 120 GLY C Protein S 3 FT #SUB 60 60 TRP F 123 122 ASP C Protein S 5 FT #SUB 62 62 PHE F 16 15 ILE C Protein S 1 FT #SUB 62 62 PHE F 96 95 GLU C Protein S 2 FT #SUB 62 62 PHE F 98 97 GLN C Protein S 5 FT #SUB 63 63 TYR F 32 31 TRP C Protein S 3 FT #SUB 65 65 LEU F 238 237 PRO C Protein S 2 FT #SUB 65 65 LEU F 239 238 ASN C Protein S 1 FT #SUB 65 65 LEU F 240 239 ALA C Protein S 2 FT #SUB 67 67 TYR F 240 239 ALA C Protein S 6 FT DISORDER 1 1 FT DISORDER 98 99 CC SEQUENCE 96 AA (ATOM); CC QRTPKIQVYS RHPAENGKSN FLNCYVSGFH PSDIEVDLLK NGERIEKVEH SDLSFSKDWS CC FYLLYYTEFT PTEKDEYACR VNHVTLSQPK IVKWDR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES IQRTPKIQVYSRHPAENGKSNFLNCYVSGFHPSDIEVDLLKNGERIEKVE CC ATOM -QRTPKIQVYSRHPAENGKSNFLNCYVSGFHPSDIEVDLLKNGERIEKVE CC ************************************************* CC SEQRES HSDLSFSKDWSFYLLYYTEFTPTEKDEYACRVNHVTLSQPKIVKWDRDM CC ATOM HSDLSFSKDWSFYLLYYTEFTPTEKDEYACRVNHVTLSQPKIVKWDR-- CC *********************************************** SQ SEQUENCE 99 AA; MW; CN; IQRTPKIQVY SRHPAENGKS NFLNCYVSGF HPSDIEVDLL KNGERIEKVE HSDLSFSKDW SFYLLYYTEF TPTEKDEYAC RVNHVTLSQP KIVKWDRDM //