Structure of PDB 2xmf Chain A Binding Site BS01

Receptor Information
>2xmf Chain A (length=60) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GPLGSPQCKALYAYDAQDTDELSFNANDIIDIIKEDPSGWWTGRLRGKQG
LFPNNYVTKI
Ligand information
Ligand IDDIA
InChIInChI=1S/C8H20N2/c9-7-5-3-1-2-4-6-8-10/h1-10H2
InChIKeyPWGJDPKCLMLPJW-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(CCCCN)CCCN
ACDLabs 10.04
CACTVS 3.341		NCCCCCCCCN
FormulaC8 H20 N2
NameOCTANE 1,8-DIAMINE;
1,8-DIAMINOOCTANE;
OCTAMETHYLENEDIAMINE;
1,8-OCTANEDIAMINE
ChEMBLCHEMBL29392
DrugBankDB04333
ZINCZINC000001677582
PDB chain2xmf Chain A Residue 1055 [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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PDB2xmf Myosin 1E SH3
Resolution1.5 Å
Binding residue
(original residue number in PDB)		D14 E15 W34
Binding residue
(residue number reindexed from 1)		D20 E21 W40
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:2xmf, PDBe:2xmf, PDBj:2xmf
PDBsum2xmf
PubMed
UniProtE9Q634|MYO1E_MOUSE Unconventional myosin-Ie (Gene Name=Myo1e)

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