Structure of PDB 7h7v Chain B Binding Site BS01

Receptor Information
>7h7v Chain B (length=163) Species: 37124 (Chikungunya virus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GAMAPSYRVKRMDIAKNDEECVVNAANPRGLPGDGVCKAVYKKWPESFKN
SATPVGTAKTVMCGTYPVIHAVGPNFSNYTESEGDRELAAAYREVAKEVT
RLGVNSVAIPLLSTGVYSGGKDRLTQSLNHLFTAMDSTDADVVIYCRDKE
WEKKISEAIQMRT
Ligand information
Ligand IDHEW
InChIInChI=1S/C5H5BrN2/c6-4-1-2-8-5(7)3-4/h1-3H,(H2,7,8)
InChIKeyBAQKUNMKVAPWGU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1cnc(cc1Br)N
CACTVS 3.385Nc1cc(Br)ccn1
FormulaC5 H5 Br N2
Name4-bromanylpyridin-2-amine
ChEMBL
DrugBank
ZINCZINC000019862889
PDB chain7h7v Chain B Residue 203 [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]
PDB7h7v Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain
Resolution1.54 Å
Binding residue
(original residue number in PDB)		M9 D10 I11 V33 C143
Binding residue
(residue number reindexed from 1)		M12 D13 I14 V36 C146
Annotation score1
Enzymatic activity
Enzyme Commision number 2.1.1.-
2.7.7.-
2.7.7.19: polynucleotide adenylyltransferase.
2.7.7.48: RNA-directed RNA polymerase.
3.1.3.84: ADP-ribose 1''-phosphate phosphatase.
3.4.22.-
3.6.1.15: nucleoside-triphosphate phosphatase.
3.6.1.74: mRNA 5'-phosphatase.
3.6.4.13: RNA helicase.
External links
PDB RCSB:7h7v, PDBe:7h7v, PDBj:7h7v
PDBsum7h7v
PubMed
UniProtQ8JUX6|POLN_CHIKS Polyprotein P1234

[Back to BioLiP]