Structure of PDB 2gag Chain A Binding Site BS01

Receptor Information
>2gag Chain A (length=965) Species: 40324 (Stenotrophomonas maltophilia) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MSKPQRLSAEQSSRARINREEALSLTVDGAKLSAFRGDTVASALLANGVR
RAGNSLYLDRPRGIFAAGVEEPNALVTVSARHEQDIDESMLPATTVPVTE
DLNATLLSGLGVLDPTKDPAYYDHVHVHTDVLVVGAGPAGLAAAREASRS
GARVMLLDERAEAGGTLLDTAGEQIDGMDSSAWIEQVTSELAEAEETTHL
QRTTVFGSYDANYLIAAQRRTVHLDGPSGPGVSRERIWHIRAKQVVLATG
AHERPIVFENNDRPGIMLAGAVRSYLNRYGVRAGARIAVATTNDSAYELV
RELAATGGVVAVIDARSSISAAAAQAVADGVQVISGSVVVDTEADENGEL
SAIVVAELDEARELGGTQRFEADVLAVAGGFNPVVHLHSQRQGKLDWDTT
IHAFVPADAVANQHLAGAMTGRLDTASALSTGAATGAAAATAAGFATVAR
TPQALETALGETRPVWLVPSVSGDDAVNYKFHFVDLQRDQTVADVLRATG
AGMKSVEHIKRYTSISTANDQGKTSGVAAIGVIAAVLGIENPAAIGTTTF
RAPYTPVAFAALAGRNRGDQLDPARITAMHSWHLSHGAEFEDVGQWKRPW
YYPQAGETMDQAVYRESKAVRDSVGMLDATTLGKIEIRGKDAAEFLNRIY
TNGYTKLKVGMGRYGVMCKADGMIFDDGVTLRLAEDRFLLHTTTGGAADV
LDWLEEWLQTEWPDLDVTCTSVTEQLATVAVVGPRSRDVIAKLASTVDVS
NEGFKFMAFKDVVLDSGIEARISRISFSGELAFEIAVPAWHGLRVWEDVY
AAGEEFNITPYGTETMHVLRAEKGFIIVGQDTDGTVTPQDAGMEWVVSKL
KDFIGNRSYSRADNAREDRKQLVSVLPVDKSLRLPEGAALVASDALASEG
ITPMEGWVTSSYDSPNLGRTFGLALIKNGRNRIGEVLKTPVGDQLVDVVV
SETVLYDPEGSRRDG
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 A Residue 997 [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)		N647 G653 T655 K851
Binding residue
(residue number reindexed from 1)		N647 G653 T655 K851
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) L350 L375 D677
Catalytic site (residue number reindexed from 1) L350 L375 D677
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0008115 sarcosine oxidase activity
GO:0016491 oxidoreductase activity
Biological Process
GO:0046653 tetrahydrofolate metabolic process

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:2gag, PDBe:2gag, PDBj:2gag
PDBsum2gag
PubMed16820168
UniProtQ3ZDQ8

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