Structure of PDB 6ju7 Chain B Binding Site BS01

Receptor Information
>6ju7 Chain B (length=438) Species: 5062 (Aspergillus oryzae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GSPYLITGIPKDPKHPLPIRKDIDDWYLEQTSAGSNRIQLTLFVEALTVI
QNRPLNDQLSYFRLAGIHGAPWTEWDGVPGGQKDSKGNPTGFAVHNNYTF
PTWHRVYVTLYEQVIYEAMLDFIKQNVPQNGKADWENEAKQWRLPYWDFA
RFARHGHDNDELRLPILVTMPMVKVLVPGQPGKQLSKPNPLYRFQMQTLM
GTLERPYAITSQKTEEHGWSFDLPFDKCQSTTKYGLLENYNADVWADGGQ
NWLRANLALNEHPWYQNLDGWDSVPTLQDMTFRLLTTGGLNWGEFSSTRY
DQAPKNWMNLEAIHNNVHNWVGGFMFSRPGRHDLKLWGAGHMSSVPVAAY
DPIFWLHHCNIDRLTAIWQTVNSGSWFNDDKSKVSKDDDLRPFHRFCTRK
VVFFRSDDVKDWRSLNYDYAITKDASRIRKEISDLYGQ
Ligand information
Ligand IDTYR
InChIInChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1
InChIKeyOUYCCCASQSFEME-QMMMGPOBSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)C(N)Cc1ccc(O)cc1
OpenEye OEToolkits 1.5.0c1cc(ccc1C[C@@H](C(=O)O)N)O
OpenEye OEToolkits 1.5.0c1cc(ccc1CC(C(=O)O)N)O
CACTVS 3.341N[CH](Cc1ccc(O)cc1)C(O)=O
CACTVS 3.341N[C@@H](Cc1ccc(O)cc1)C(O)=O
FormulaC9 H11 N O3
NameTYROSINE
ChEMBLCHEMBL925
DrugBankDB00135
ZINCZINC000000266964
PDB chain6ju7 Chain B Residue 2601 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB6ju7 Copper-Oxygen Dynamics in the Tyrosinase Mechanism.
Resolution1.42 Å
Binding residue
(original residue number in PDB)		H328 N329 H332 N333 M356 S357 V359
Binding residue
(residue number reindexed from 1)		H314 N315 H318 N319 M342 S343 V345
Annotation score5
Enzymatic activity
Enzyme Commision number 1.14.18.1: tyrosinase.
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity

View graph for
Molecular Function
External links
PDB RCSB:6ju7, PDBe:6ju7, PDBj:6ju7
PDBsum6ju7
PubMed32356371
UniProtA0A1S9DK56

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