Structure of PDB 8aer Chain A Binding Site BS02

Receptor Information
>8aer Chain A (length=626) Species: 324602 (Chloroflexus aurantiacus J-10-fl) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VGWAESLIGLHLGKVALITGGSAGIGGQIGRLLALSGARVMLAARDRHKL
EQMQAMIQSELAEVGYTDVEDRVHIAPGCDVSSEAQLADLVERTLSAFGT
VDYLINNAGIAGVEEMVIDMPVEGWRHTLFANLISNYSLMRKLAPLMKKQ
GSGYILNVSSYFGGEKDAAIPAPNRADYAVSKAGQRAMAEVFARFLGPEI
QINAIAPGPVELFARRARLILENKRLNELHAALIAAARTDERSMHELVEL
LLPNDVAALEQNPAAPTALRELARRFRSEGDPAASSSSALLNRSIAAKLL
ARLHNGGYVLPADIFANLPNPPDPFFTRAQIDREARKVRDGIMGMLYLQR
MPTEFDVAMATVYYLADRNVSGETFHPSGGLRYERTPTGGELFGLPSPER
LAELVGSTVYLIGEHLTEHLNLLARAYLERYGARQVVMIVETETGAETMR
RLLHDHVEAGRLMTIVAGDQIEAAIDQAITRYGRPGPVVCTPFRPLPTVP
LVGRKDSDWSTVLSEAEFAELCEHQLTHHFRVARKIALSDGASLALVTPE
TTATSTTEQFALANFIKTTLHAFTATIGVESERTAQRILINQVDLTRRAR
ADPHERQQELERFIEAVLLVTAPLPP
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 chain8aer Chain A Residue 1302 [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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PDB8aer Dynamic lid domain of Chloroflexus aurantiacus Malonyl-CoA Reductase controls the reaction
Resolution1.77 Å
Binding residue
(original residue number in PDB)		S1152 Q1157 R1158 I1159
Binding residue
(residue number reindexed from 1)		S581 Q586 R587 I588
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links