Structure of PDB 1jmb Chain A Binding Site BS02

Receptor Information
>1jmb Chain A (length=48) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DYLRELLKLELQAIKQYREALEYVKLPVLAKILEDEEKHIEWLETILG
Ligand information
Ligand IDDMS
InChIInChI=1S/C2H6OS/c1-4(2)3/h1-2H3
InChIKeyIAZDPXIOMUYVGZ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341C[S](C)=O
ACDLabs 10.04sulfinyldimethane
OpenEye OEToolkits 1.5.0CS(=O)C
FormulaC2 H6 O S
NameDIMETHYL SULFOXIDE
ChEMBLCHEMBL504
DrugBankDB01093
ZINCZINC000005224188
PDB chain1jmb Chain A Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1jmb Toward the de novo design of a catalytically active helix bundle: a substrate-accessible carboxylate-bridged dinuclear metal center.
Resolution2.2 Å
Binding residue
(original residue number in PDB)		E10 E36
Binding residue
(residue number reindexed from 1)		E10 E36
Annotation score1
External links