Structure of PDB 1zne Chain A Binding Site BS01

Receptor Information
>1zne Chain A (length=157) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EEASSTGRNFNVEKINGEWHTIILASDKREKIEDNGNFRLFLEQIHVLEK
SLVLKFHTVRDEECSELSMVADKTEKAGEYSVTYDGFNTFTIPKTDYDNF
LMAHLINEKDGETFQLMGLYGREPDLSSDIKERFAQLCEEHGILRENIID
LSNANRC
Ligand information
Ligand IDHE2
InChIInChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3
InChIKeyZSIAUFGUXNUGDI-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341
OpenEye OEToolkits 1.5.0		CCCCCCO
ACDLabs 10.04OCCCCCC
FormulaC6 H14 O
NameHEXAN-1-OL
ChEMBLCHEMBL14085
DrugBank
ZINCZINC000001699882
PDB chain1zne Chain A Residue 500 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1zne Strong Solute-Solute Dispersive Interactions in a Protein-Ligand Complex.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		L24 F38 L40 L105 Y120
Binding residue
(residue number reindexed from 1)		L24 F38 L40 L105 Y120
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0036094 small molecule binding

View graph for
Molecular Function
External links
PDB RCSB:1zne, PDBe:1zne, PDBj:1zne
PDBsum1zne
PubMed16316253
UniProtP11589|MUP2_MOUSE Major urinary protein 2 (Gene Name=Mup2)

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