Structure of PDB 2gsy Chain F Binding Site BS01

Receptor Information
>2gsy Chain F (length=433) Species: 10995 (Infectious bursal disease virus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TQQIVPFIRSLLMPTTGPASIPDDTLEKHTLRSETSTYNLTVGDTGSGLI
VFFPGFPGSIVGAHYTLQGNGNYKFDQMLLTAQNLPASYNYCRLVSRSLT
VRSSTLPGGVYALNGTINAVTFQGSLSELTDVSYNGLMSATANINDKIGN
VLVGEGVTVLSLPTSYDLGYVRLGDPIPAIGLDPKMVATCDSSDRPRVYT
ITAADDYQFSSQYQPGGVTITLFSANIDAITSLSVGGELVFRTSVHGLVL
GATIYLIGFDGTTVITRAVAANNGLTTGTDNLMPFNLVIPTNEITQPITS
IKLEIVTSKSGGQAGDQMSWSARGSLAVTIHGGNYPGALRPVTLVAYERV
ATGSVVTVAGVSNFELIPNPELAKNLVTEYGRFDPGAMNYTKLILSERDR
LGIKTVWPTREYTDFREYFMEVADLNSPLKIAG
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain2gsy Chain F Residue 505 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2gsy The 2.6-angstrom structure of infectious bursal disease virus-derived t=1 particles reveals new stabilizing elements of the virus capsid.
Resolution2.6 Å
Binding residue
(original residue number in PDB)
D31 D174
Binding residue
(residue number reindexed from 1)
D24 D167
Annotation score4
Enzymatic activity
Enzyme Commision number 3.4.21.-
Gene Ontology
Molecular Function
GO:0005198 structural molecule activity

View graph for
Molecular Function
External links
PDB RCSB:2gsy, PDBe:2gsy, PDBj:2gsy
PDBsum2gsy
PubMed16809295
UniProtP61825|POLS_IBDV Structural polyprotein

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