Structure of PDB 9f9m Chain A Binding Site BS01
Receptor Information
>9f9m Chain A (length=179) Species:
9606
(Homo sapiens) [
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PLELRPGEYRVLLCVDIGETRLLRELQRLHVTHTVRKLHVGDFVWVAQET
NPRDPANPGELVLDHIVERKRLDDLCSSIIDGRFREQKFRLKRCGLERRV
YLVEESLPESTLLQAVTNTQVIDGFFVKRTADIKESAAYLALLTRGLQRL
YQGHTLRSRPWGTPNPLCSLLTFSDFNAG
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
9f9m Chain A Residue 601 [
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Receptor-Ligand Complex Structure
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PDB
9f9m
Fragment-Based Discovery of Novel MUS81 Inhibitors.
Resolution
2.469 Å
Binding residue
(original residue number in PDB)
G306 D307
Binding residue
(residue number reindexed from 1)
G41 D42
Annotation score
4
External links
PDB
RCSB:9f9m
,
PDBe:9f9m
,
PDBj:9f9m
PDBsum
9f9m
PubMed
39015284
UniProt
Q96NY9
|MUS81_HUMAN Crossover junction endonuclease MUS81 (Gene Name=MUS81)
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