Structure of PDB 2gag Chain B Binding Site BS04

Receptor Information
>2gag Chain B (length=403) Species: 40324 (Stenotrophomonas maltophilia) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DLLPEHPEFLWANPEPKKSYDAIIVGGGGHGLATAYFLAKNHGITNVAVL
EKGWLAGGNMARNTTIIRSNYLWDESAGIYEKSLKLWEQLPEDLEYDFLF
SQRGVLNLAHTLGDVRESVRRVEANKLNGVDAEWLDPSQVKEACPIINTS
DDIRYPVMGATWQPRAGIAKHDHVAWAFARKANEMGVDIIQNCEVTGFIK
DGEKVTGVKTTRGTIHAGKVALAGAGHSSVLAEMAGFELPIQSHPLQALV
SELFEPVHPTVVMSNHIHVYVSQAHKGELVMGAGIDSYNGYGQRGAFHVI
QEQMAAAVELFPIFARAHVLRTWGGIVDTTMDASPIISKTPIQNLYVNCG
WGTGGFKGTPGAGFTLAHTIANDEPHELNKPFSLERFETGHLIDEHGAAA
VAH
Ligand information
Ligand IDFOA
InChIInChI=1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)
InChIKeySMNDYUVBFMFKNZ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)c1occc1
OpenEye OEToolkits 1.5.0c1cc(oc1)C(=O)O
CACTVS 3.341OC(=O)c1occc1
FormulaC5 H4 O3
Name2-FUROIC ACID
ChEMBLCHEMBL1232797
DrugBank
ZINCZINC000000158555
PDB chain2gag Chain B Residue 503 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2gag Heterotetrameric sarcosine oxidase: structure of a diflavin metalloenzyme at 1.85 a resolution.
Resolution1.85 Å
Binding residue
(original residue number in PDB)		T66 I68 R70 M265 Y272 K359 V403
Binding residue
(residue number reindexed from 1)		T64 I66 R68 M263 Y270 K357 V401
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) A63 T66 T67
Catalytic site (residue number reindexed from 1) A61 T64 T65
Enzyme Commision number 1.5.3.24: sarcosine oxidase (5,10-methylenetetrahydrofolate-forming).
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0008115 sarcosine oxidase activity
GO:0016491 oxidoreductase activity
Biological Process
GO:0046653 tetrahydrofolate metabolic process
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:2gag, PDBe:2gag, PDBj:2gag
PDBsum2gag
PubMed16820168
UniProtQ3ZDR0

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