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Related entries of code: 2i3i
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1oxnRCSB PDB    PDBbind140aa, >1OXN_1|Chains... *
1oxqRCSB PDB    PDBbind140aa, >1OXQ_1|Chains... at 100%
1oy7RCSB PDB    PDBbind140aa, >1OY7_1|Chains... at 100%
2i3hRCSB PDB    PDBbind133aa, >2I3H_1|Chains... at 90%
3f7gRCSB PDB    PDBbind140aa, >3F7G_1|Chains... at 99%
3f7hRCSB PDB    PDBbind133aa, >3F7H_1|Chains... at 90%
3f7iRCSB PDB    PDBbind133aa, >3F7I_1|Chains... at 90%
3gt9RCSB PDB    PDBbind133aa, >3GT9_1|Chains... at 90%
3gtaRCSB PDB    PDBbind133aa, >3GTA_1|Chains... at 90%
3uw5RCSB PDB    PDBbind116aa, >3UW5_1|Chains... at 90%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID2i3i
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namebaculoviral iap repeat-containing protein 7
Ligand Name618
EC.Number E.C.-.-.-.-
Resolution 2.3(Å)
Affinity (Kd/Ki/IC50)Ki=0.05uM
Release Year2006
Protein/NA SequenceCheck fasta file
Primary Reference Chem.Biol.v1;pp.525-533
Ligand Properties
Formula C25H35N6O3S
Molecular Weight 499.649
Exact Mass 499.249
No. of atoms 70
No. of bonds 73
Polar Surface Area 138.24
LOGP Value 2.80      (Computed with XLOGP3)
1.82      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 4
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): Q96CA5  
Entrez Gene IDNCBI Entrez Gene ID: 79444  
ASDInformation of known allosteric effects of PDB entries

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