Structure of PDB 4jx0 Chain B Binding Site BS01
Receptor Information
>4jx0 Chain B (length=302) Species:
272559
(Bacteroides fragilis NCTC 9343) [
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KYIEEDIREQLGIDPFTDLVYLGYYGNPYTQLEAINDLVNTTLVGKNELS
FKVKVTKPYKEDIKVNLMKEDKLVTDFPEMAEGIPLFPSENCTFEGGVLK
AGELETTVKLTLKDVEKLNNLSGYVMAIKLTMEGSHEHLAIARTRSSYFV
KLNLSIRLDNIDSSNKKIEGKGFNKEISFKSDIRPDKLGSLNDGNFTANN
WYTSNANNYLTIILPEKQSLKGFRLDTNTSPSGSYMLKSCRVMVETPDGN
WVNHGVFDRKSMDGIAYISFKKPVECTKVRFENMMAFNGRFSVDVNEVTA
FR
Ligand information
Ligand ID
MG
InChI
InChI=1S/Mg/q+2
InChIKey
JLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Mg+2]
CACTVS 3.341
[Mg++]
Formula
Mg
Name
MAGNESIUM ION
ChEMBL
DrugBank
DB01378
ZINC
PDB chain
4jx0 Chain B Residue 402 [
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Receptor-Ligand Complex Structure
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PDB
4jx0
Crystal structure of a hypothetical protein (BF3416) from Bacteroides fragilis NCTC 9343 at 2.90 A resolution
Resolution
2.9 Å
Binding residue
(original residue number in PDB)
S231 D234 N236 N337 E338
Binding residue
(residue number reindexed from 1)
S190 D193 N195 N296 E297
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:4jx0
,
PDBe:4jx0
,
PDBj:4jx0
PDBsum
4jx0
PubMed
UniProt
Q5L9W9
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