ID 4E5WA STANDARD; PRT; 302 AA. DT CONVERTED FROM PDB (SEQRES) 4E5W DE Tyrosine-protein kinase JAK1 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.860 CC R-Factor 0.184 FT #SUB 185 1037 VAL A 251 1103 ARG B Protein B 3 FT #SUB 186 1038 LYS A 244 1096 HIS B Protein B 2 FT #SUB 186 1038 LYS A 251 1103 ARG B Protein B 2 FT #SUB 188 1040 ASP A 244 1096 HIS B Protein S 8 FT #SUB 188 1040 ASP A 247 1099 MET B Protein A 9 FT #SUB 188 1040 ASP A 251 1103 ARG B Protein S 6 FT #SUB 189 1041 ARG A 243 1095 THR B Protein S 11 FT #SUB 189 1041 ARG A 244 1096 HIS B Protein A 3 FT #SUB 189 1041 ARG A 245 1097 GLY B Protein S 1 FT #SUB 189 1041 ARG A 246 1098 GLN B Protein B 4 FT #SUB 191 1043 SER A 246 1098 GLN B Protein B 1 FT #SUB 193 1045 VAL A 247 1099 MET B Protein S 1 FT #SUB 201 1053 LEU A 247 1099 MET B Protein B 1 FT #SUB 201 1053 LEU A 250 1102 THR B Protein B 3 FT #SUB 202 1054 MET A 254 1106 ASN B Protein B 3 FT #SUB 203 1055 GLN A 254 1106 ASN B Protein S 1 FT #SUB 204 1056 SER A 251 1103 ARG B Protein S 5 FT #SUB 243 1095 THR A 189 1041 ARG B Protein B 5 FT #SUB 244 1096 HIS A 186 1038 LYS B Protein S 2 FT #SUB 244 1096 HIS A 188 1040 ASP B Protein A 8 FT #SUB 244 1096 HIS A 189 1041 ARG B Protein B 3 FT #SUB 245 1097 GLY A 189 1041 ARG B Protein B 2 FT #SUB 246 1098 GLN A 189 1041 ARG B Protein S 3 FT #SUB 246 1098 GLN A 191 1043 SER B Protein S 1 FT #SUB 246 1098 GLN A 249 1101 VAL B Protein B 1 FT #SUB 247 1099 MET A 188 1040 ASP B Protein S 9 FT #SUB 247 1099 MET A 193 1045 VAL B Protein S 1 FT #SUB 247 1099 MET A 201 1053 LEU B Protein S 1 FT #SUB 249 1101 VAL A 246 1098 GLN B Protein S 1 FT #SUB 249 1101 VAL A 250 1102 THR B Protein S 1 FT #SUB 250 1102 THR A 201 1053 LEU B Protein S 3 FT #SUB 250 1102 THR A 249 1101 VAL B Protein S 1 FT #SUB 250 1102 THR A 250 1102 THR B Protein S 1 FT #SUB 251 1103 ARG A 185 1037 VAL B Protein S 3 FT #SUB 251 1103 ARG A 186 1038 LYS B Protein S 2 FT #SUB 251 1103 ARG A 188 1040 ASP B Protein S 6 FT #SUB 251 1103 ARG A 204 1056 SER B Protein S 5 FT #SUB 254 1106 ASN A 202 1054 MET B Protein S 3 FT #SUB 254 1106 ASN A 203 1055 GLN B Protein S 1 FT #SUB 257 1109 LYS A 257 1109 LYS B Protein S 1 FT #HET 29 881 LEU A 1 1201 0NT A A 7 FT #HET 30 882 GLY A 1 1201 0NT A B 4 FT #HET 31 883 GLU A 1 1201 0NT A B 10 FT #HET 32 884 GLY A 1 1201 0NT A B 4 FT #HET 37 889 VAL A 1 1201 0NT A S 4 FT #HET 54 906 ALA A 1 1201 0NT A S 4 FT #HET 86 938 VAL A 1 1201 0NT A S 2 FT #HET 104 956 MET A 1 1201 0NT A S 3 FT #HET 105 957 GLU A 1 1201 0NT A B 5 FT #HET 106 958 PHE A 1 1201 0NT A A 7 FT #HET 107 959 LEU A 1 1201 0NT A B 6 FT #HET 110 962 GLY A 1 1201 0NT A B 1 FT #HET 151 1003 ASP A 1 1201 0NT A S 3 FT #HET 155 1007 ARG A 1 1201 0NT A A 8 FT #HET 156 1008 ASN A 1 1201 0NT A S 9 FT #HET 158 1010 LEU A 1 1201 0NT A S 13 FT #HET 168 1020 GLY A 1 1201 0NT A B 1 FT #HET 169 1021 ASP A 1 1201 0NT A S 3 FT #HET 245 1097 GLY A 2 1201 PEG B B 4 FT #HET 246 1098 GLN A 2 1201 PEG B A 4 FT DISORDER 60 64 FT DISORDER 95 97 CC SEQUENCE 294 AA (ATOM); CC GDIVSEKKPA TEVDPTHFEK RFLKRIRDLG EGHFGKVELC RYDPEGDNTG EQVAVKSLKN CC HIADLKKEIE ILRNLYHENI VKYKGICTEN GIKLIMEFLP SGSLKEYLPK NKNKINLKQQ CC LKYAVQICKG MDYLGSRQYV HRDLAARNVL VESEHQVKIG DFGLTKAIET DKEYYTVKDD CC RDSPVFWYAP ECLMQSKFYI ASDVWSFGVT LHELLTYCDS DSSPMALFLK MIGPTHGQMT CC VTRLVNTLKE GKRLPCPPNC PDEVYQLMRK CWEFQPSNRT SFQNLIEGFE ALLK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GDIVSEKKPATEVDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTG CC ATOM GDIVSEKKPATEVDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTG CC ************************************************** CC SEQRES EQVAVKSLKPESGGNHIADLKKEIEILRNLYHENIVKYKGICTEDGGNGI CC ATOM EQVAVKSLK-----NHIADLKKEIEILRNLYHENIVKYKGICTE---NGI CC ********* ****************************** *** CC SEQRES KLIMEFLPSGSLKEYLPKNKNKINLKQQLKYAVQICKGMDYLGSRQYVHR CC ATOM KLIMEFLPSGSLKEYLPKNKNKINLKQQLKYAVQICKGMDYLGSRQYVHR CC ************************************************** CC SEQRES DLAARNVLVESEHQVKIGDFGLTKAIETDKEYYTVKDDRDSPVFWYAPEC CC ATOM DLAARNVLVESEHQVKIGDFGLTKAIETDKEYYTVKDDRDSPVFWYAPEC CC ************************************************** CC SEQRES LMQSKFYIASDVWSFGVTLHELLTYCDSDSSPMALFLKMIGPTHGQMTVT CC ATOM LMQSKFYIASDVWSFGVTLHELLTYCDSDSSPMALFLKMIGPTHGQMTVT CC ************************************************** CC SEQRES RLVNTLKEGKRLPCPPNCPDEVYQLMRKCWEFQPSNRTSFQNLIEGFEAL CC ATOM RLVNTLKEGKRLPCPPNCPDEVYQLMRKCWEFQPSNRTSFQNLIEGFEAL CC ************************************************** CC SEQRES LK CC ATOM LK CC ** SQ SEQUENCE 302 AA; MW; CN; GDIVSEKKPA TEVDPTHFEK RFLKRIRDLG EGHFGKVELC RYDPEGDNTG EQVAVKSLKP ESGGNHIADL KKEIEILRNL YHENIVKYKG ICTEDGGNGI KLIMEFLPSG SLKEYLPKNK NKINLKQQLK YAVQICKGMD YLGSRQYVHR DLAARNVLVE SEHQVKIGDF GLTKAIETDK EYYTVKDDRD SPVFWYAPEC LMQSKFYIAS DVWSFGVTLH ELLTYCDSDS SPMALFLKMI GPTHGQMTVT RLVNTLKEGK RLPCPPNCPD EVYQLMRKCW EFQPSNRTSF QNLIEGFEAL LK // ID 4E5WB STANDARD; PRT; 302 AA. DT CONVERTED FROM PDB (SEQRES) 4E5W DE Tyrosine-protein kinase JAK1 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.860 CC R-Factor 0.184 FT #SUB 185 1037 VAL B 251 1103 ARG A Protein B 3 FT #SUB 186 1038 LYS B 244 1096 HIS A Protein B 2 FT #SUB 186 1038 LYS B 251 1103 ARG A Protein B 2 FT #SUB 188 1040 ASP B 244 1096 HIS A Protein S 8 FT #SUB 188 1040 ASP B 247 1099 MET A Protein A 9 FT #SUB 188 1040 ASP B 251 1103 ARG A Protein S 6 FT #SUB 189 1041 ARG B 243 1095 THR A Protein S 5 FT #SUB 189 1041 ARG B 244 1096 HIS A Protein A 3 FT #SUB 189 1041 ARG B 245 1097 GLY A Protein S 2 FT #SUB 189 1041 ARG B 246 1098 GLN A Protein B 3 FT #SUB 191 1043 SER B 246 1098 GLN A Protein B 1 FT #SUB 193 1045 VAL B 247 1099 MET A Protein S 1 FT #SUB 201 1053 LEU B 247 1099 MET A Protein B 1 FT #SUB 201 1053 LEU B 250 1102 THR A Protein B 3 FT #SUB 202 1054 MET B 254 1106 ASN A Protein B 3 FT #SUB 203 1055 GLN B 254 1106 ASN A Protein S 1 FT #SUB 204 1056 SER B 251 1103 ARG A Protein S 5 FT #SUB 243 1095 THR B 189 1041 ARG A Protein A 11 FT #SUB 244 1096 HIS B 186 1038 LYS A Protein S 2 FT #SUB 244 1096 HIS B 188 1040 ASP A Protein A 8 FT #SUB 244 1096 HIS B 189 1041 ARG A Protein B 3 FT #SUB 245 1097 GLY B 189 1041 ARG A Protein B 1 FT #SUB 246 1098 GLN B 189 1041 ARG A Protein S 4 FT #SUB 246 1098 GLN B 191 1043 SER A Protein S 1 FT #SUB 246 1098 GLN B 249 1101 VAL A Protein B 1 FT #SUB 247 1099 MET B 188 1040 ASP A Protein S 9 FT #SUB 247 1099 MET B 193 1045 VAL A Protein S 1 FT #SUB 247 1099 MET B 201 1053 LEU A Protein S 1 FT #SUB 249 1101 VAL B 246 1098 GLN A Protein S 1 FT #SUB 249 1101 VAL B 250 1102 THR A Protein S 1 FT #SUB 250 1102 THR B 201 1053 LEU A Protein S 3 FT #SUB 250 1102 THR B 249 1101 VAL A Protein S 1 FT #SUB 250 1102 THR B 250 1102 THR A Protein S 1 FT #SUB 251 1103 ARG B 185 1037 VAL A Protein S 3 FT #SUB 251 1103 ARG B 186 1038 LYS A Protein S 2 FT #SUB 251 1103 ARG B 188 1040 ASP A Protein S 6 FT #SUB 251 1103 ARG B 204 1056 SER A Protein S 5 FT #SUB 254 1106 ASN B 202 1054 MET A Protein S 3 FT #SUB 254 1106 ASN B 203 1055 GLN A Protein S 1 FT #SUB 257 1109 LYS B 257 1109 LYS A Protein S 1 FT #HET 29 881 LEU B 3 1202 0NT B A 6 FT #HET 30 882 GLY B 3 1202 0NT B B 3 FT #HET 31 883 GLU B 3 1202 0NT B B 11 FT #HET 32 884 GLY B 3 1202 0NT B B 3 FT #HET 37 889 VAL B 3 1202 0NT B S 4 FT #HET 54 906 ALA B 3 1202 0NT B S 4 FT #HET 86 938 VAL B 3 1202 0NT B S 3 FT #HET 104 956 MET B 3 1202 0NT B S 2 FT #HET 105 957 GLU B 3 1202 0NT B B 5 FT #HET 106 958 PHE B 3 1202 0NT B A 7 FT #HET 107 959 LEU B 3 1202 0NT B A 7 FT #HET 110 962 GLY B 3 1202 0NT B B 1 FT #HET 151 1003 ASP B 3 1202 0NT B S 1 FT #HET 155 1007 ARG B 3 1202 0NT B A 8 FT #HET 156 1008 ASN B 3 1202 0NT B S 8 FT #HET 158 1010 LEU B 3 1202 0NT B S 12 FT #HET 168 1020 GLY B 3 1202 0NT B B 1 FT #HET 169 1021 ASP B 3 1202 0NT B S 3 FT #HET 245 1097 GLY B 2 1201 PEG B B 6 FT #HET 246 1098 GLN B 2 1201 PEG B A 4 FT DISORDER 1 12 FT DISORDER 61 64 FT DISORDER 95 97 FT DISORDER 178 179 FT DISORDER 302 302 CC SEQUENCE 280 AA (ATOM); CC VDPTHFEKRF LKRIRDLGEG HFGKVELCRY DPEGDNTGEQ VAVKSLKPNH IADLKKEIEI CC LRNLYHENIV KYKGICTENG IKLIMEFLPS GSLKEYLPKN KNKINLKQQL KYAVQICKGM CC DYLGSRQYVH RDLAARNVLV ESEHQVKIGD FGLTKAIEKE YYTVKDDRDS PVFWYAPECL CC MQSKFYIASD VWSFGVTLHE LLTYCDSDSS PMALFLKMIG PTHGQMTVTR LVNTLKEGKR CC LPCPPNCPDE VYQLMRKCWE FQPSNRTSFQ NLIEGFEALL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GDIVSEKKPATEVDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTG CC ATOM ------------VDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTG CC ************************************** CC SEQRES EQVAVKSLKPESGGNHIADLKKEIEILRNLYHENIVKYKGICTEDGGNGI CC ATOM EQVAVKSLKP----NHIADLKKEIEILRNLYHENIVKYKGICTE---NGI CC ********** ****************************** *** CC SEQRES KLIMEFLPSGSLKEYLPKNKNKINLKQQLKYAVQICKGMDYLGSRQYVHR CC ATOM KLIMEFLPSGSLKEYLPKNKNKINLKQQLKYAVQICKGMDYLGSRQYVHR CC ************************************************** CC SEQRES DLAARNVLVESEHQVKIGDFGLTKAIETDKEYYTVKDDRDSPVFWYAPEC CC ATOM DLAARNVLVESEHQVKIGDFGLTKAIE--KEYYTVKDDRDSPVFWYAPEC CC *************************** ********************* CC SEQRES LMQSKFYIASDVWSFGVTLHELLTYCDSDSSPMALFLKMIGPTHGQMTVT CC ATOM LMQSKFYIASDVWSFGVTLHELLTYCDSDSSPMALFLKMIGPTHGQMTVT CC ************************************************** CC SEQRES RLVNTLKEGKRLPCPPNCPDEVYQLMRKCWEFQPSNRTSFQNLIEGFEAL CC ATOM RLVNTLKEGKRLPCPPNCPDEVYQLMRKCWEFQPSNRTSFQNLIEGFEAL CC ************************************************** CC SEQRES LK CC ATOM L- CC * SQ SEQUENCE 302 AA; MW; CN; GDIVSEKKPA TEVDPTHFEK RFLKRIRDLG EGHFGKVELC RYDPEGDNTG EQVAVKSLKP ESGGNHIADL KKEIEILRNL YHENIVKYKG ICTEDGGNGI KLIMEFLPSG SLKEYLPKNK NKINLKQQLK YAVQICKGMD YLGSRQYVHR DLAARNVLVE SEHQVKIGDF GLTKAIETDK EYYTVKDDRD SPVFWYAPEC LMQSKFYIAS DVWSFGVTLH ELLTYCDSDS SPMALFLKMI GPTHGQMTVT RLVNTLKEGK RLPCPPNCPD EVYQLMRKCW EFQPSNRTSF QNLIEGFEAL LK //