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Related entries of code: 3ip5
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3ip6RCSB PDB    PDBbind356aa, >3IP6:A|PDBID|CHAIN|... at 100%
3ip9RCSB PDB    PDBbind356aa, >3IP9:A|PDBID|CHAIN|... at 100%
3ipaRCSB PDB    PDBbind356aa, >3IPA:A|PDBID|CHAIN|... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3f48RCSB PDB    PDBbindALA
3ipaRCSB PDB    PDBbindALA
4io5RCSB PDB    PDBbindALA
4ykjRCSB PDB    PDBbindALA

Entry Information
PDB ID3ip5
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameABC transporter, substrate binding protein (Amino acid);Atu2422-GABA receptor
Ligand NameALA
EC.Number E.C.-.-.-.-
Resolution 1.35(Å)
Affinity (Kd/Ki/IC50)Kd=0.6uM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference (2010) J.Biol.Chem. Vol. 285: pp. 30294-30303
Ligand Properties
Formula C3H8NO2
Molecular Weight 90.101
Exact Mass 90.056
No. of atoms 14
No. of bonds 13
Polar Surface Area 64.94
LOGP Value -2.11      (Computed with XLOGP3)
-1.30      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 0
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): Q7CX36  
Entrez Gene IDNCBI Entrez Gene ID: 1134460  
ASDInformation of known allosteric effects of PDB entries

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