eF-site ID 1qhi-B PDB Code 1qhi Chain B click to enlarge Title HERPES SIMPLEX VIRUS TYPE-I THYMIDINE KINASE COMPLEXED WITH A NOVEL NON-SUBSTRATE INHIBITOR, 9-(4-HYDROXYBUTYL)-N2-PHENYLGUANINE Classification TRANSFERASE Compound PROTEIN (THYMIDINE KINASE) Source Human herpesvirus 1 (strain 17) (HHV-1) (Human herpes simplex virus 1) (KITH_HSV11) Sequence B:  MPTLLRVYIDGPHGMGKTTTTQLLVALGDIVYVPEPMTYW RVLGASETIANIYTTQHRLDQGEISAGDAAVVMTSAQITM GMPYAVTDAVLAPHIGGEAGPPALTLIFDRHPIAALLCYP AARYLMGSMTPQAVLAFVALIPPTLPGTNIVLGALPEDRH IDRLAKRQRPGERLDLAMLAAIRRVYGLLANTVRYLQCGG SWREDWGQLSAGPRPHIGDTLFTLFRAPELLAPNGDLYNV FAWALDVLAKRLRSMHVFILDYDQSPAGCRDALLQLTSGM VQTHVTTPGSIPTICDLARTFAREMGEA Description Functional site 1) chain B residue 58 type sequence H description BINDING SITE FOR RESIDUE SO4 B 4 source : AC2 2) chain B residue 59 type sequence G description BINDING SITE FOR RESIDUE SO4 B 4 source : AC2 3) chain B residue 60 type sequence M description BINDING SITE FOR RESIDUE SO4 B 4 source : AC2 4) chain B residue 61 type sequence G description BINDING SITE FOR RESIDUE SO4 B 4 source : AC2 5) chain B residue 62 type sequence K description BINDING SITE FOR RESIDUE SO4 B 4 source : AC2 6) chain B residue 63 type sequence T description BINDING SITE FOR RESIDUE SO4 B 4 source : AC2 7) chain B residue 222 type sequence R description BINDING SITE FOR RESIDUE SO4 B 4 source : AC2 8) chain B residue 83 type sequence E description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 9) chain B residue 88 type sequence W description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 10) chain B residue 100 type sequence I description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 11) chain B residue 101 type sequence Y description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 12) chain B residue 121 type sequence M description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 13) chain B residue 125 type sequence Q description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 14) chain B residue 128 type sequence M description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 15) chain B residue 132 type sequence Y description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 16) chain B residue 163 type sequence R description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 17) chain B residue 168 type sequence A description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 18) chain B residue 172 type sequence Y description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 19) chain B residue 176 type sequence R description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 20) chain B residue 222 type sequence R description BINDING SITE FOR RESIDUE BPG B 2 source : AC4 21) chain B residue 62 type catalytic sequence K description 588 source MCSA : MCSA2 22) chain B residue 83 type catalytic sequence E description 588 source MCSA : MCSA2 23) chain B residue 162 type catalytic sequence D description 588 source MCSA : MCSA2 24) chain B residue 163 type catalytic sequence R description 588 source MCSA : MCSA2 25) chain B residue 220 type catalytic sequence R description 588 source MCSA : MCSA2 26) chain B residue 222 type catalytic sequence R description 588 source MCSA : MCSA2 27) chain B residue 225 type catalytic sequence E description 588 source MCSA : MCSA2 28) chain B residue 83 type ACT_SITE sequence E description Proton acceptor => ECO:0000255|HAMAP-Rule:MF_04029 source Swiss-Prot : SWS_FT_FI1 29) chain B residue 222 type BINDING sequence R description BINDING => ECO:0000255|HAMAP-Rule:MF_04029 source Swiss-Prot : SWS_FT_FI2 30) chain B residue 56 type BINDING sequence G description BINDING => ECO:0000255|HAMAP-Rule:MF_04029 source Swiss-Prot : SWS_FT_FI2 31) chain B residue 101 type BINDING sequence Y description BINDING => ECO:0000255|HAMAP-Rule:MF_04029 source Swiss-Prot : SWS_FT_FI2 32) chain B residue 125 type BINDING sequence Q description BINDING => ECO:0000255|HAMAP-Rule:MF_04029 source Swiss-Prot : SWS_FT_FI2 33) chain B residue 216 type BINDING sequence R description BINDING => ECO:0000255|HAMAP-Rule:MF_04029 source Swiss-Prot : SWS_FT_FI2

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