Structure of PDB 3nxl Chain C Binding Site BS02

Receptor Information
>3nxl Chain C (length=425) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GTPRVTRMQVIPVAGRDSMLLNLCGAHAPYFTRNLVILDDSSGHTGVGEV
PGGEGIRHALERMTDLVVGQSIGRYQATLNAVRAALSRLDNVITAIEAAL
LDLLGQHLDVPVAALLGEGQQRDAVPMLAYLFYIGDRGRTDLPYRDEAQA
RTPWFRLRNEEALTPAAIARQAEAAVDRYGFADFKLKGGVMAGADEMEAI
AAIKACFPDARATLDPNGAWSLDEAVALCRGQGHLLAYAEDPCGPEGGYS
GREVMAEFRRATGIPTATNMIATDWRQMDHAVRLQAVDIPLADPHFWTMQ
GSVRLAQLCRDWGLTWGSHSNNHFDVSLAMFTHAAAAAPGTITAIDTHWI
WQEGDARLTREPLKIVGGQVAVPERPGLGIELDMAQVEAAHALYKEVGGT
ARDDAVAMRYLVPGWTYDPKRPSFG
Ligand information
Ligand IDCO3
InChIInChI=1S/CH2O3/c2-1(3)4/h(H2,2,3,4)/p-2
InChIKeyBVKZGUZCCUSVTD-UHFFFAOYSA-L
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(=O)([O-])[O-]
ACDLabs 10.04
CACTVS 3.341		[O-]C([O-])=O
FormulaC O3
NameCARBONATE ION
ChEMBL
DrugBankDB14531
ZINC
PDB chain3nxl Chain C Residue 477 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB3nxl Crystal structure of Glucarate dehydratase from Burkholderia cepacia complexed with magnesium
Resolution1.885 Å
Binding residue
(original residue number in PDB)		H36 H388
Binding residue
(residue number reindexed from 1)		H27 H348
Annotation score1
Enzymatic activity
Enzyme Commision number 4.2.1.40: glucarate dehydratase.
Gene Ontology
Molecular Function
GO:0008872 glucarate dehydratase activity
GO:0016829 lyase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:3nxl, PDBe:3nxl, PDBj:3nxl
PDBsum3nxl
PubMed
UniProtQ39KL8

[Back to BioLiP]