eF-site ID 3f69-A PDB Code 3f69 Chain A click to enlarge Title Crystal structure of the Mycobacterium tuberculosis PknB mutant kinase domain in complex with KT5720 Classification TRANSFERASE Compound Serine/threonine-protein kinase pknB Source (PKNB_MYCTU) Sequence A:  TPSHLSDRYELGEILGFGGMSEVHLARDLRDHRDVAVKVL RADLARDPSFYLRFRREAQNAAALNHPAIVAVYDTGEAET PAGPLPYIVMEYVDGVTLRDIVHTEGPMTPKRAIEVIADA CQALNFSHQNGIIHRDVKPANILISATNAVKVVDFGIARA ITAQYLSPEQARGDSVDARSDVYSLGCVLYEVLTGEPPFT GDSPVSVAYQHVREDPIPPSARHEGLSADLDAVVLKALAK NPENRYQTAAEMRADLVRVHNGEPPEAPKV Description Functional site 1) chain A residue 17 type sequence L description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 2) chain A residue 18 type sequence G description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 3) chain A residue 25 type sequence V description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 4) chain A residue 38 type sequence A description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 5) chain A residue 93 type sequence E description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 6) chain A residue 95 type sequence V description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 7) chain A residue 97 type sequence G description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 8) chain A residue 142 type sequence A description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 9) chain A residue 143 type sequence N description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 10) chain A residue 155 type sequence V description BINDING SITE FOR RESIDUE XDR A 309 source : AC1 11) chain A residue 10 type sequence R description BINDING SITE FOR RESIDUE SO4 A 310 source : AC2 12) chain A residue 32 type sequence R description BINDING SITE FOR RESIDUE SO4 A 310 source : AC2 13) chain A residue 256 type sequence A description BINDING SITE FOR RESIDUE SO4 A 311 source : AC3 14) chain A residue 257 type sequence K description BINDING SITE FOR RESIDUE SO4 A 311 source : AC3 15) chain A residue 258 type sequence N description BINDING SITE FOR RESIDUE SO4 A 311 source : AC3 16) chain A residue 261 type sequence N description BINDING SITE FOR RESIDUE SO4 A 311 source : AC3 17) chain A residue 17-40 type prosite sequence LGFGGMSEVHLARDLRDHRDVAVK description PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGFGGMSEVHlArdlrdhrd..........VAVK source prosite : PS00107 18) chain A residue 134-146 type prosite sequence IIHRDVKPANILI description PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. IiHrDVKpaNILI source prosite : PS00108 19) chain A residue 138 type ACT_SITE sequence D description Proton acceptor source Swiss-Prot : SWS_FT_FI1 20) chain A residue 17 type BINDING sequence L description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000269|PubMed:12548283, ECO:0000269|PubMed:12551895 source Swiss-Prot : SWS_FT_FI2 21) chain A residue 40 type BINDING sequence K description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000269|PubMed:12548283, ECO:0000269|PubMed:12551895 source Swiss-Prot : SWS_FT_FI2 22) chain A residue 93 type BINDING sequence E description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000269|PubMed:12548283, ECO:0000269|PubMed:12551895 source Swiss-Prot : SWS_FT_FI2 23) chain A residue 140 type BINDING sequence K description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000269|PubMed:12548283, ECO:0000269|PubMed:12551895 source Swiss-Prot : SWS_FT_FI2 24) chain A residue 143 type BINDING sequence N description source Swiss-Prot : SWS_FT_FI3 25) chain A residue 156 type BINDING sequence D description source Swiss-Prot : SWS_FT_FI3

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