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Related entries of code: 1nd5
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2hpaRCSB PDB    PDBbind342aa, >2HPA_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1nd5
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameprostatic acid phosphatase
Ligand Name2BF
EC.Number E.C.3.1.3.2
Resolution 2.9(Å)
Affinity (Kd/Ki/IC50)IC50=4nM
Release Year2002
Protein/NA SequenceCheck fasta file
Primary Reference Biochemistry v42 pp. 383-9, 2003
Ligand Properties
Formula C14H18NO3P
Molecular Weight 279.271
Exact Mass 279.102
No. of atoms 37
No. of bonds 38
Polar Surface Area 90.89
LOGP Value -1.35      (Computed with XLOGP3)
1.19      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 2
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): P15309  
Entrez Gene IDNCBI Entrez Gene ID: 55  
ASDInformation of known allosteric effects of PDB entries

 
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