Structure of PDB 6a99 Chain D Binding Site BS03

Receptor Information
>6a99 Chain D (length=198) Species: 70812 (Mastigocladus laminosus UTEX LB 1931) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SAVSIPIKNAGFEEPSLTDYYTIDTPPGWITYDPNGLVPAKRTRITSNNG
VGYTGPNSAYYNHKAPEGRNVAYVYLAQEIGSGIAGLEQTLDAVLKPNTK
YTLTVDIGNSGGSFQGFPLDGFPGYRVELLAGDTVLAADQNNLYIKEKDF
KTTTVTFIATPESPYLGQHLGIRLINPLQGKFSGVDFDNVRLTAEPAE
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 chain6a99 Chain D Residue 303 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6a99 The Crystal Structure of a Class of Cyclases that Catalyze the Cope Rearrangement
Resolution2.29 Å
Binding residue
(original residue number in PDB)		D62 V67
Binding residue
(residue number reindexed from 1)		D33 V38
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:6a99, PDBe:6a99, PDBj:6a99
PDBsum6a99
PubMed30222239
UniProtA0A1P8VSL7

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