ID 4I5CA STANDARD; PRT; 302 AA. DT CONVERTED FROM PDB (SEQRES) 4I5C DE Tyrosine-protein kinase JAK1 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.100 CC R-Factor 0.193 FT #SUB 185 1037 VAL A 251 1103 ARG B Protein B 2 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 6 FT #SUB 188 1040 ASP A 251 1103 ARG B Protein S 5 FT #SUB 189 1041 ARG A 243 1095 THR B Protein S 7 FT #SUB 189 1041 ARG A 244 1096 HIS B Protein A 4 FT #SUB 189 1041 ARG A 245 1097 GLY B Protein S 1 FT #SUB 191 1043 SER A 246 1098 GLN B Protein B 1 FT #SUB 193 1045 VAL A 246 1098 GLN B Protein S 3 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 250 1102 THR B Protein B 2 FT #SUB 202 1054 MET A 254 1106 ASN B Protein B 3 FT #SUB 203 1055 GLN A 254 1106 ASN B Protein B 1 FT #SUB 204 1056 SER A 251 1103 ARG B Protein S 1 FT #SUB 243 1095 THR A 189 1041 ARG B Protein A 7 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 247 1099 MET A 188 1040 ASP B Protein S 8 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 247 1099 MET A 249 1101 VAL B Protein S 2 FT #SUB 249 1101 VAL A 246 1098 GLN B Protein S 2 FT #SUB 249 1101 VAL A 247 1099 MET B Protein S 1 FT #SUB 250 1102 THR A 201 1053 LEU B Protein S 3 FT #SUB 251 1103 ARG A 186 1038 LYS B Protein S 1 FT #SUB 251 1103 ARG A 188 1040 ASP B Protein S 5 FT #SUB 254 1106 ASN A 202 1054 MET B Protein S 4 FT #SUB 254 1106 ASN A 203 1055 GLN B Protein S 3 FT #SUB 257 1109 LYS A 257 1109 LYS B Protein S 1 FT #HET 29 881 LEU A 1 1201 C5I A S 5 FT #HET 30 882 GLY A 1 1201 C5I A B 5 FT #HET 31 883 GLU A 1 1201 C5I A B 4 FT #HET 32 884 GLY A 1 1201 C5I A B 2 FT #HET 35 887 GLY A 1 1201 C5I A B 2 FT #HET 36 888 LYS A 1 1201 C5I A B 2 FT #HET 37 889 VAL A 1 1201 C5I A A 7 FT #HET 54 906 ALA A 1 1201 C5I A S 4 FT #HET 56 908 LYS A 1 1201 C5I A S 1 FT #HET 86 938 VAL A 1 1201 C5I A S 2 FT #HET 104 956 MET A 1 1201 C5I A S 2 FT #HET 105 957 GLU A 1 1201 C5I A B 4 FT #HET 106 958 PHE A 1 1201 C5I A A 5 FT #HET 107 959 LEU A 1 1201 C5I A A 8 FT #HET 110 962 GLY A 1 1201 C5I A B 1 FT #HET 155 1007 ARG A 1 1201 C5I A B 1 FT #HET 156 1008 ASN A 1 1201 C5I A S 2 FT #HET 158 1010 LEU A 1 1201 C5I A S 13 FT #HET 168 1020 GLY A 1 1201 C5I A B 3 FT #HET 169 1021 ASP A 1 1201 C5I A S 4 FT #HET 246 1098 GLN A 5 1204 EDO B A 3 FT DISORDER 1 12 FT DISORDER 61 64 FT DISORDER 94 97 FT DISORDER 179 179 CC SEQUENCE 281 AA (ATOM); CC VDPTHFEKRF LKRIRDLGEG HFGKVELCRY DPEGDNTGEQ VAVKSLKPNH IADLKKEIEI CC LRNLYHENIV KYKGICTNGI KLIMEFLPSG SLKEYLPKNK NKINLKQQLK YAVQICKGMD CC YLGSRQYVHR DLAARNVLVE SEHQVKIGDF GLTKAIETKE YYTVKDDRDS PVFWYAPECL CC MQSKFYIASD VWSFGVTLHE LLTYCDSDSS PMALFLKMIG PTHGQMTVTR LVNTLKEGKR CC LPCPPNCPDE VYQLMRKCWE FQPSNRTSFQ NLIEGFEALL K CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GDIVSEKKPATEVDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTG CC ATOM ------------VDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTG CC ************************************** CC SEQRES EQVAVKSLKPESGGNHIADLKKEIEILRNLYHENIVKYKGICTEDGGNGI CC ATOM EQVAVKSLKP----NHIADLKKEIEILRNLYHENIVKYKGICT----NGI CC ********** ***************************** *** CC SEQRES KLIMEFLPSGSLKEYLPKNKNKINLKQQLKYAVQICKGMDYLGSRQYVHR CC ATOM KLIMEFLPSGSLKEYLPKNKNKINLKQQLKYAVQICKGMDYLGSRQYVHR CC ************************************************** CC SEQRES DLAARNVLVESEHQVKIGDFGLTKAIETDKEYYTVKDDRDSPVFWYAPEC CC ATOM DLAARNVLVESEHQVKIGDFGLTKAIET-KEYYTVKDDRDSPVFWYAPEC 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 4I5CB STANDARD; PRT; 302 AA. DT CONVERTED FROM PDB (SEQRES) 4I5C DE Tyrosine-protein kinase JAK1 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.100 CC R-Factor 0.193 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 1 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 8 FT #SUB 188 1040 ASP B 251 1103 ARG A Protein S 5 FT #SUB 189 1041 ARG B 243 1095 THR A Protein S 7 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 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 4 FT #SUB 203 1055 GLN B 254 1106 ASN A Protein S 3 FT #SUB 243 1095 THR B 189 1041 ARG A Protein A 7 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 4 FT #SUB 245 1097 GLY B 189 1041 ARG A Protein B 1 FT #SUB 246 1098 GLN B 191 1043 SER A Protein S 1 FT #SUB 246 1098 GLN B 193 1045 VAL A Protein S 3 FT #SUB 246 1098 GLN B 249 1101 VAL A Protein S 2 FT #SUB 247 1099 MET B 188 1040 ASP A Protein S 6 FT #SUB 247 1099 MET B 201 1053 LEU A Protein S 1 FT #SUB 247 1099 MET B 249 1101 VAL A Protein S 1 FT #SUB 249 1101 VAL B 247 1099 MET A Protein S 2 FT #SUB 250 1102 THR B 201 1053 LEU A Protein S 3 FT #SUB 250 1102 THR B 202 1054 MET A Protein S 2 FT #SUB 251 1103 ARG B 185 1037 VAL A Protein S 2 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 5 FT #SUB 251 1103 ARG B 204 1056 SER A Protein S 1 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 14 866 ASP B 3 1202 EDO B B 2 FT #HET 15 867 PRO B 3 1202 EDO B B 7 FT #HET 17 869 HIS B 3 1202 EDO B B 3 FT #HET 18 870 PHE B 3 1202 EDO B S 6 FT #HET 23 875 LEU B 4 1203 EDO B A 3 FT #HET 25 877 ARG B 4 1203 EDO B B 1 FT #HET 27 879 ARG B 2 1201 EDO B S 6 FT #HET 29 881 LEU B 2 1201 EDO B S 3 FT #HET 29 881 LEU B 6 1205 C5I B S 4 FT #HET 30 882 GLY B 6 1205 C5I B B 5 FT #HET 31 883 GLU B 6 1205 C5I B B 7 FT #HET 32 884 GLY B 6 1205 C5I B B 5 FT #HET 35 887 GLY B 6 1205 C5I B B 2 FT #HET 36 888 LYS B 6 1205 C5I B B 3 FT #HET 37 889 VAL B 6 1205 C5I B A 7 FT #HET 38 890 GLU B 4 1203 EDO B S 3 FT #HET 40 892 CYS B 4 1203 EDO B S 2 FT #HET 42 894 TYR B 3 1202 EDO B S 2 FT #HET 54 906 ALA B 6 1205 C5I B S 4 FT #HET 55 907 VAL B 4 1203 EDO B S 1 FT #HET 56 908 LYS B 6 1205 C5I B S 2 FT #HET 86 938 VAL B 6 1205 C5I B S 1 FT #HET 101 953 LYS B 4 1203 EDO B S 5 FT #HET 104 956 MET B 6 1205 C5I B S 3 FT #HET 105 957 GLU B 6 1205 C5I B B 4 FT #HET 106 958 PHE B 2 1201 EDO B S 1 FT #HET 106 958 PHE B 6 1205 C5I B A 5 FT #HET 107 959 LEU B 6 1205 C5I B A 7 FT #HET 108 960 PRO B 2 1201 EDO B B 3 FT #HET 110 962 GLY B 2 1201 EDO B B 3 FT #HET 110 962 GLY B 6 1205 C5I B B 1 FT #HET 155 1007 ARG B 6 1205 C5I B B 2 FT #HET 156 1008 ASN B 6 1205 C5I B S 2 FT #HET 158 1010 LEU B 6 1205 C5I B S 12 FT #HET 168 1020 GLY B 6 1205 C5I B B 3 FT #HET 169 1021 ASP B 6 1205 C5I B S 3 FT #HET 245 1097 GLY B 5 1204 EDO B B 3 FT #HET 246 1098 GLN B 5 1204 EDO B A 5 FT DISORDER 61 65 FT DISORDER 95 98 CC SEQUENCE 293 AA (ATOM); CC GDIVSEKKPA TEVDPTHFEK RFLKRIRDLG EGHFGKVELC RYDPEGDNTG EQVAVKSLKP CC HIADLKKEIE ILRNLYHENI VKYKGICTEG IKLIMEFLPS GSLKEYLPKN KNKINLKQQL CC KYAVQICKGM DYLGSRQYVH RDLAARNVLV ESEHQVKIGD FGLTKAIETD KEYYTVKDDR CC DSPVFWYAPE CLMQSKFYIA SDVWSFGVTL HELLTYCDSD SSPMALFLKM IGPTHGQMTV CC TRLVNTLKEG KRLPCPPNCP DEVYQLMRKC WEFQPSNRTS FQNLIEGFEA LLK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GDIVSEKKPATEVDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTG CC ATOM GDIVSEKKPATEVDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTG CC ************************************************** CC SEQRES EQVAVKSLKPESGGNHIADLKKEIEILRNLYHENIVKYKGICTEDGGNGI CC ATOM EQVAVKSLKP-----HIADLKKEIEILRNLYHENIVKYKGICTE----GI 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 //