Structure of PDB 8wdb Chain D Binding Site BS03

Receptor Information
>8wdb Chain D (length=513) Species: 83332 (Mycobacterium tuberculosis H37Rv) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
APLLSVEGLEVTFGTDAPAVCGVDLAVRSGQTVAVVGESGSGKSTTAAAI
LGLLPAGGRITAGRVVFDGRDITGADAKRLRSIRGREIGYVPQDPMTNLN
PVWKVGFQVTEALRANTDGRAARRRAVELLAEAGLPDPAKQAGRYPHQLS
GGMCQRALIAIGLAGRPRLLIADQPTSALDVTVQRQVLDHLQGLTDELGT
ALLLITHDLALAAQRAEAVVVVRRGVVVESGAAQSILQSPQHEYTRRLVA
AAPSLGDILVVSELTKIYRESRGAPWRRVESRAVDGVSFRLPRASTLAIV
GESGSGKSTLARMVLGLLQPTSGTVVFDGTYDVGALARDQVLAFRRRVQP
VFQNPYSSLDPMYSVFRAIEEPLRVHHVGDRRQRQRAVRELVDQVALPSS
ILGRRPRELSGGQRQRVAIARALALRPEVLVCDQAVSALDVLVQAQILDL
LADLQADLGLTYLFISHDLAVIRQIADDVLVMRAGRVVEHASTEEVFSRP
RHEYTRQLLQAIP
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 chain8wdb Chain D Residue 603 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB8wdb Cryo-EM structure of the ATP-bound DppABCD complex
Resolution2.86 Å
Binding residue
(original residue number in PDB)		S49 Q98
Binding residue
(residue number reindexed from 1)		S44 Q93
Annotation score4
External links