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Related entries of code: 2aig
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3aigRCSB PDB    PDBbind202aa, >3AIG_1|Chain... at 99%
4aigRCSB PDB    PDBbind201aa, >4AIG_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 ID2aig
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameadamalysin ii
Ligand Name0GR
EC.Number E.C.3.4.24.46
Resolution 2.6(Å)
Affinity (Kd/Ki/IC50)IC50=10uM
Release Year1998
Protein/NA SequenceCheck fasta file
Primary Reference Protein Sci. v7 pp. 283-92, 1998
Ligand Properties
Formula C22H25N3O5
Molecular Weight 411.451
Exact Mass 411.179
No. of atoms 55
No. of bonds 57
Polar Surface Area 124.43
LOGP Value 4.26      (Computed with XLOGP3)
3.50      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 8
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): P34179  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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