Structure of PDB 3mmh Chain A Binding Site BS05

Receptor Information
>3mmh Chain A (length=167) Species: 604162 (Neisseria meningitidis 8013) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MHALHFSASDKAALYREVLPQIESVVADETDWVANLANTAAVLKEAFGWF
WVGFYLVDTRSDELVLAPFQGPLACTRIPFGRGVCGQAWAKGGTVVVGDV
DAHPDHIACSSLSRSEIVVPLFSDGRCIGVLDADSEHLAQFDETDALYLG
ELAKILEKRFEASRQAV
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain3mmh Chain A Residue 172 [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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PDB3mmh Structural and Biochemical Characterization of Free Methionine-R-sulfoxide Reductase from Neisseria meningitidis.
Resolution1.25 Å
Binding residue
(original residue number in PDB)		W49 Q140 D145
Binding residue
(residue number reindexed from 1)		W49 Q140 D145
Annotation score4
External links