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Structure of PDB 1js1 Chain Y Binding Site BS01

Receptor Information
>1js1 Chain Y (length=318) Species: 817 (Bacteroides fragilis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKKFTCVQDIGDLKSALAESFEIKKDRFKYVELGRNKTLLMIFFNSSLRT
RLSTQKAALNLGMNVIVLDINQGAWKLETERGVIMDGDKPEHLLEAIPVM
GCYCDIIGVRSFARFENREYDYNEVIINQFIQHSGRPVFSMEAATRHPLQ
SFADLITIEEYKKTARPKVVMTWAPHPRPLPQAVPNSFAEWMNATDYEFV
ITHPEGYELDPKFVGNARVEYDQMKAFEGADFIYAKNWAAYTGDNYGQIL
STDRNWTVGDRQMAVTNNAYFMHCLPVRRNMIVTDDVIESPQSIVIPEAA
NREISATVVLKRLLENLP
Ligand information
Ligand IDPO4
InChIInChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3
InChIKeyNBIIXXVUZAFLBC-UHFFFAOYSA-K
SMILES
SoftwareSMILES
CACTVS 3.341[O-][P]([O-])([O-])=O
ACDLabs 10.04[O-]P([O-])([O-])=O
OpenEye OEToolkits 1.5.0[O-]P(=O)([O-])[O-]
FormulaO4 P
NamePHOSPHATE ION
ChEMBL
DrugBankDB14523
ZINC
PDB chain1js1 Chain Y Residue 502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1js1 Crystal structure of a transcarbamylase-like protein from the anaerobic bacterium Bacteroides fragilis at 2.0 A resolution.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		S47 R49 T50 R110
Binding residue
(residue number reindexed from 1)		S47 R49 T50 R110
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) K236
Catalytic site (residue number reindexed from 1) K236
Enzyme Commision number 2.1.3.11: N-succinylornithine carbamoyltransferase.
Gene Ontology
Molecular Function
GO:0004585 ornithine carbamoyltransferase activity
GO:0016597 amino acid binding
GO:0016740 transferase activity
GO:0016743 carboxyl- or carbamoyltransferase activity
Biological Process
GO:0006520 amino acid metabolic process
GO:0006526 L-arginine biosynthetic process
GO:0019240 citrulline biosynthetic process
GO:0042450 arginine biosynthetic process via ornithine

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Molecular Function
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Biological Process
External links
PDB RCSB:1js1, PDBe:1js1, PDBj:1js1
PDBsum1js1
PubMed12095263
UniProtQ8A1E9|SOTC_BACTN N-succinylornithine carbamoyltransferase (Gene Name=argF')

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