Structure of PDB 4uc9 Chain B Binding Site BS01

Receptor Information
>4uc9 Chain B (length=219) Species: 11259 (Human respiratory syncytial virus A2) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SIDTPNYDVQKHINKLCGMLLITEDANHKFTGLIGMLYAMSRLGREDTIK
ILRDAGYHVKANGVDVTTHRQDINGKEMKFEVLTLASLTTEIQINIEIES
RKSYKKMLKEMGEVAPEYRHDSPDCGMIILCIAALVITKLADRSGLTAVI
RRANNVLKNEMKRYKGLLPKDIANSFYEVFEKHPHFIDVFVHFGIAQSST
RGGSRVEGIFAGLFMNAYG
Ligand information
Ligand IDPHE
InChIInChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1
InChIKeyCOLNVLDHVKWLRT-QMMMGPOBSA-N
SMILES
SoftwareSMILES
CACTVS 3.341N[CH](Cc1ccccc1)C(O)=O
CACTVS 3.341N[C@@H](Cc1ccccc1)C(O)=O
OpenEye OEToolkits 1.5.0c1ccc(cc1)CC(C(=O)O)N
OpenEye OEToolkits 1.5.0c1ccc(cc1)C[C@@H](C(=O)O)N
ACDLabs 10.04O=C(O)C(N)Cc1ccccc1
FormulaC9 H11 N O2
NamePHENYLALANINE
ChEMBLCHEMBL301523
DrugBankDB00120
ZINCZINC000000105196
PDB chain4uc9 Chain B Residue 1301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4uc9 A Druggable Pocket at the Nucleocapsid/Phosphoprotein Interaction Site of the Human Respiratory Syncytial Virus.
Resolution2.4 Å
Binding residue
(original residue number in PDB)		M50 S131 R132 Y135 H151
Binding residue
(residue number reindexed from 1)		M19 S100 R101 Y104 H120
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Cellular Component
GO:0019013 viral nucleocapsid

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Molecular Function
View graph for
Cellular Component
External links
PDB RCSB:4uc9, PDBe:4uc9, PDBj:4uc9
PDBsum4uc9
PubMed26246564
UniProtP03418|NCAP_HRSVA Nucleoprotein (Gene Name=N)

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