Structure of PDB 6sbi Chain B Binding Site BS02

Receptor Information
>6sbi Chain B (length=216) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TKPLSRFWEWGKNIVCVGRNYADHVKEMRSTVLSEPVLFLKPSTAYAPEG
SPVLMPAYCRNLHHEVELGVLLGKRGEAIPEAAAMDYVAGYALCLDMTAR
DVQEECKKKGLPWTLAKSFTSSCPVSAFVPKEKIPDPHALRLWLKVNGEL
RQEGKTSSMIFSIPYIISYVSKIITLEEGDLILTGTPKGVGPIKENDEIE
AGIDGVVSMRFKVKRS
Ligand information
Ligand IDOXL
InChIInChI=1S/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6)/p-2
InChIKeyMUBZPKHOEPUJKR-UHFFFAOYSA-L
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341		[O-]C(=O)C([O-])=O
OpenEye OEToolkits 1.5.0C(=O)(C(=O)[O-])[O-]
FormulaC2 O4
NameOXALATE ION
ChEMBL
DrugBank
ZINC
PDB chain6sbi Chain B Residue 304 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6sbi Structural and functional comparison of fumarylacetoacetate domain containing protein 1 in human and mouse.
Resolution2.7 Å
Binding residue
(original residue number in PDB)		G27 R28 H33 E74 K126
Binding residue
(residue number reindexed from 1)		G18 R19 H24 E65 K117
Annotation score2
Enzymatic activity
Catalytic site (original residue number in PDB) S52 T184 V199
Catalytic site (residue number reindexed from 1) S43 T175 V190
Enzyme Commision number 3.7.1.5: acylpyruvate hydrolase.
4.1.1.112: oxaloacetate decarboxylase.
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0008948 oxaloacetate decarboxylase activity
GO:0016787 hydrolase activity
GO:0016829 lyase activity
GO:0016853 isomerase activity
GO:0018773 acetylpyruvate hydrolase activity
GO:0034545 fumarylpyruvate hydrolase activity
GO:0046872 metal ion binding
GO:0047621 acylpyruvate hydrolase activity
GO:0050163 oxaloacetate tautomerase activity
Biological Process
GO:0006090 pyruvate metabolic process
GO:0006107 oxaloacetate metabolic process
Cellular Component
GO:0005654 nucleoplasm
GO:0005737 cytoplasm
GO:0005739 mitochondrion
GO:0005743 mitochondrial inner membrane
GO:0005759 mitochondrial matrix
GO:0005829 cytosol

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6sbi, PDBe:6sbi, PDBj:6sbi
PDBsum6sbi
PubMed32068790
UniProtQ8R0F8|FAHD1_MOUSE Oxaloacetate tautomerase FAHD1, mitochondrial (Gene Name=Fahd1)

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