Structure of PDB 3q4q Chain A Binding Site BS02

Receptor Information
>3q4q Chain A (length=169) Species: 243232 (Methanocaldococcus jannaschii DSM 2661) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PISEEEKEGLIEMREEEKLARDVYLTLYNKWKLQIFKNIAESEQTHMDAV
KYLLEKYNIPDPVKNDSIGVFSNPKFEELYKKLVEKGDKSEVDALKVGAT
IEDLDIADLEKWINKTDNEDIKFVYENLMKGSRNHMRAFVRMLNNYGSNY
TPQYISKEEYEEIISSSTE
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain3q4q Chain A Residue 202 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB3q4q Structural insights into the metal binding properties of hypothetical protein MJ0754 from Methanococcus jannaschii.
Resolution1.75 Å
Binding residue
(original residue number in PDB)		E28 E54 H57
Binding residue
(residue number reindexed from 1)		E17 E43 H46
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:3q4q, PDBe:3q4q, PDBj:3q4q
PDBsum3q4q
PubMed21604308
UniProtQ58164|Y754_METJA Uncharacterized protein MJ0754 (Gene Name=MJ0754)

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