Browse entries in the PDBbind-CN Database

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Related entries of code: 4d3h
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4wk1RCSB PDB    PDBbind129aa, >4WK1_1|Chain... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
4qshRCSB PDB    PDBbind2BA
4qskRCSB PDB    PDBbind2BA
4rwwRCSB PDB    PDBbind2BA
4wk1RCSB PDB    PDBbind2BA
4xttRCSB PDB    PDBbind2BA
4yp1RCSB PDB    PDBbind2BA
5f29RCSB PDB    PDBbind2BA
5ks7RCSB PDB    PDBbind2BA
5uxfRCSB PDB    PDBbind2BA
6a03RCSB PDB    PDBbind2BA
Entry Information
PDB ID4d3h
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameStaphylococcus aureus PII-like signal transduction protein PstA
Ligand Name2BA
EC.Number E.C.-.-.-.-
Resolution 2(Å)
Affinity (Kd/Ki/IC50)Kd=0.37uM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2015) J.Biol.Chem. Vol. 290: pp. 2888
Ligand Properties
Formula C20H26N10O12P2
Molecular Weight 660.428
Exact Mass 660.121
No. of atoms 70
No. of bonds 76
Polar Surface Area 343.18
LOGP Value -5.28      (Computed with XLOGP3)
-1.35      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 12
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 22
No. of Rings: 7
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): Q2G229  
Entrez Gene IDNCBI Entrez Gene ID: 3920312  
ASDInformation of known allosteric effects of PDB entries
 
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