Structure of PDB 8wlw Chain D Binding Site BS01

Receptor Information
>8wlw Chain D (length=156) Species: 246196 (Mycolicibacterium smegmatis MC2 155) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AISDADLKYLRRCVDLAREALDDGDEPFGSVLVDHTGTTLFEDRNRVKDG
DATAHPEFAIARWAARHLTPDRRARATVYTSGEHCPMCAAAHAWVGLGRI
VYATSSAQLGGWLTEWGAQAPVATLPINTVAPGVVVDGPAEELAETMHNL
YRAKFG
Ligand information
Ligand IDWHC
InChIInChI=1S/C3H3N3O2/c7-2-4-1-5-3(8)6-2/h1H,(H2,4,5,6,7,8)
InChIKeyGEWRKGDRYZIFNP-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7C1=NC(=O)NC(=O)N1
CACTVS 3.385O=C1NC=NC(=O)N1
FormulaC3 H3 N3 O2
Name1~{H}-1,3,5-triazine-2,4-dione;
5-azauracil
ChEMBL
DrugBank
ZINC
PDB chain8wlw Chain D Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8wlw Crystal structure of DelP123_Msd in complex with 5-azauracil
Resolution1.538 Å
Binding residue
(original residue number in PDB)		F29 H56 E58
Binding residue
(residue number reindexed from 1)		F28 H55 E57
Annotation score1
External links