Structure of PDB 2hxw Chain B Binding Site BS01
Receptor Information
>2hxw Chain B (length=230) Species:
197
(Campylobacter jejuni) [
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VNLYGPGGPHTALKDIANKYSEKTGVKVNVNFGPQATWFEKAKKDADILF
GASDQSALAIASDFGKDFNVSKIKPLYFREAIILTQKGNPLKIKGLKDLA
NKKVRIVVPEGAGKSNTSGTGVWEDMIGRTQDIKTIQNFRNNIVAFVPNS
GSARKLFAQDQADAWITWIDWSKSNPDIGTAVAIEKDLVVYRTFNVIAKE
GASKETQDFIAYLSSKEAKEIFKKYGWREH
Ligand information
Ligand ID
FLC
InChI
InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3
InChIKey
KRKNYBCHXYNGOX-UHFFFAOYSA-K
SMILES
Software
SMILES
CACTVS 3.341
OC(CC([O-])=O)(CC([O-])=O)C([O-])=O
OpenEye OEToolkits 1.5.0
C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O
ACDLabs 10.04
O=C([O-])CC(O)(C([O-])=O)CC(=O)[O-]
Formula
C6 H5 O7
Name
CITRATE ANION
ChEMBL
DrugBank
ZINC
PDB chain
2hxw Chain B Residue 301 [
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Receptor-Ligand Complex Structure
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PDB
2hxw
Structural context for protein N-glycosylation in bacteria: The structure of PEB3, an adhesin from Campylobacter jejuni.
Resolution
1.6 Å
Binding residue
(original residue number in PDB)
P27 G28 G54 P55 T138 S139 N170 S173
Binding residue
(residue number reindexed from 1)
P6 G7 G33 P34 T117 S118 N149 S152
Annotation score
3
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0140104
molecular carrier activity
Biological Process
GO:1902358
sulfate transmembrane transport
Cellular Component
GO:0042597
periplasmic space
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:2hxw
,
PDBe:2hxw
,
PDBj:2hxw
PDBsum
2hxw
PubMed
17456748
UniProt
Q0PBL7
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