Structure of PDB 5ibz Chain C Binding Site BS01

Receptor Information
>5ibz Chain C (length=301) Species: 155900 (uncultured organism) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KLNNWGKWGDDDQRGAANYITPERIVAAARLIQTGKTFSLAIPIDSNGPV
FPPRLPPHHTMEITGADYVADPGASPFGKSPIRFADDYIYMPLQGSTQWD
ALSHGWYGESLYNGVPEAAIRSSGAGGATKLGIENVKTSFLGRGVLVDIV
RFKGGSLPEGYTITRADLEGALAKQKSKLLPGDILVIRTGLVESWYDLDP
VGRASFFLNPMTGIGSDTVPWIHEQRLAGVAADNIALERVPHLPVHGNLL
RDLGVYIGEIWWLEELAKDCAQDGRYEFFLAAQPLYIPGAVGSPLNPIAV
K
Ligand information
Ligand IDUVW
InChIInChI=1S/C2H5O5P/c1-2(3)7-8(4,5)6/h1H3,(H2,4,5,6)
InChIKeyLIPOUNRJVLNBCD-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341CC(=O)O[P](O)(O)=O
OpenEye OEToolkits 1.5.0CC(=O)OP(=O)(O)O
ACDLabs 10.04O=C(OP(=O)(O)O)C
FormulaC2 H5 O5 P
NameACETYLPHOSPHATE
ChEMBL
DrugBankDB02897
ZINCZINC000003869379
PDB chain5ibz Chain C Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5ibz Crystal structure of a novel cyclase (pfam04199).
Resolution1.611 Å
Binding residue
(original residue number in PDB)		R87 H137 H286 E299
Binding residue
(residue number reindexed from 1)		R54 H104 H246 E259
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004061 arylformamidase activity
Biological Process
GO:0019441 tryptophan catabolic process to kynurenine

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Molecular Function
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Biological Process
External links
PDB RCSB:5ibz, PDBe:5ibz, PDBj:5ibz
PDBsum5ibz
PubMed
UniProtA0A0G3FEK2

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