Browse entries in the PDBbind-CN Database

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Related entries of code: 4nrt
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4lq3RCSB PDB    PDBbind526aa, >4LQ3_1|Chain... *
4lq9RCSB PDB    PDBbind526aa, >4LQ9_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
4nruRCSB PDB    PDBbind2NG

Entry Information
PDB ID4nrt
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NamehNV-RdRp
Ligand Name2NG
EC.Number E.C.-.-.-.-
Resolution 2.02(Å)
Affinity (Kd/Ki/IC50)IC50=1000nM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2014) Plos One Vol. 9.e91765: pp.1-10
Ligand Properties
Formula C18H20N2O7S2
Molecular Weight 440.491
Exact Mass 440.071
No. of atoms 49
No. of bonds 51
Polar Surface Area 227.1
LOGP Value 1.35      (Computed with XLOGP3)
5.80      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 3
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
UniProtKB ACUniProt accession number (AC): A0ZNP5  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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