Browse entries in the PDBbind-CN Database

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Related entries of code: 2a3w
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2a3xRCSB PDB    PDBbind204aa, >2A3X_1|Chains... at 100%
2w08RCSB PDB    PDBbind204aa, >2W08_1|Chains... at 100%
3kqrRCSB PDB    PDBbind204aa, >3KQR_1|Chains... at 100%
4avsRCSB PDB    PDBbind204aa, >4AVS_1|Chains... at 100%
4avtRCSB PDB    PDBbind204aa, >4AVT_1|Chains... at 100%
4ayuRCSB PDB    PDBbind204aa, >4AYU_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 ID2a3w
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameserum amyloid p-component
Ligand NameCPJ
EC.Number E.C.-.-.-.-
Resolution 2.2(Å)
Affinity (Kd/Ki/IC50)IC50=3.8uM
Release Year2005
Protein/NA SequenceCheck fasta file
Primary Reference J.Biol.Chem. v280 pp. 31999-2008, 2005
Ligand Properties
Formula C16H24N2O12
Molecular Weight 436.368
Exact Mass 436.133
No. of atoms 54
No. of bonds 55
Polar Surface Area 188.18
LOGP Value 0.35      (Computed with XLOGP3)
-0.35      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 14
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): P02743  
Entrez Gene IDNCBI Entrez Gene ID: 325  
ASDInformation of known allosteric effects of PDB entries

 
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