Browse entries in the PDBbind-CN Database

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Related entries of code: 3a73
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1gniRCSB PDB    PDBbind585aa, >1GNI_1|Chain... *
1gnjRCSB PDB    PDBbind585aa, >1GNJ_1|Chain... at 100%
1h9zRCSB PDB    PDBbind585aa, >1H9Z_1|Chain... at 100%
1ha2RCSB PDB    PDBbind585aa, >1HA2_1|Chain... at 100%
1hk1RCSB PDB    PDBbind585aa, >1HK1_1|Chain... at 100%
1hk2RCSB PDB    PDBbind585aa, >1HK2_1|Chain... at 99%
1hk3RCSB PDB    PDBbind585aa, >1HK3_1|Chain... at 99%
1hk4RCSB PDB    PDBbind585aa, >1HK4_1|Chain... at 100%
1hk5RCSB PDB    PDBbind585aa, >1HK5_1|Chain... at 99%
2ydfRCSB PDB    PDBbind585aa, >2YDF_1|Chains... at 100%
3cx9RCSB PDB    PDBbind582aa, >3CX9_1|Chain... at 100%
6ezqRCSB PDB    PDBbind585aa, >6EZQ_1|Chain... 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 ID3a73
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameHuman serum albumin
Ligand NamePJ2
EC.Number E.C.-.-.-.-
Resolution 2.19(Å)
Affinity (Kd/Ki/IC50)Kd=420uM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference J.Am.Chem.Soc., 132, 824-832
Ligand Properties
Formula C20H30O4
Molecular Weight 334.450
Exact Mass 334.214
No. of atoms 54
No. of bonds 54
Polar Surface Area 74.6
LOGP Value 5.06      (Computed with XLOGP3)
4.06      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 1
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): P02768  
Entrez Gene IDNCBI Entrez Gene ID: 213  
ASDInformation of known allosteric effects of PDB entries

 
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