Browse entries in the PDBbind-CN Database

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Related entries of code: 4iaw
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3dszRCSB PDB    PDBbind186aa, >3DSZ_1|Chains... at 93%
4iaxRCSB PDB    PDBbind188aa, >4IAX_1|Chain... at 94%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3dszRCSB PDB    PDBbindLIZ
4iaxRCSB PDB    PDBbindLIZ
Entry Information
PDB ID4iaw
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameNeutrophil gelatinase-associated lipocalin (mutation)
Ligand NameLIZ
EC.Number E.C.-.-.-.-
Resolution 2.4(Å)
Affinity (Kd/Ki/IC50)Kd=0.234nM
Release Year2013
Protein/NA SequenceCheck fasta file
Primary Reference (2014) J.Struct.Biol. Vol. 185: pp. 203-214
Ligand Properties
Formula C26H40N5O10S
Molecular Weight 614.688
Exact Mass 614.250
No. of atoms 82
No. of bonds 83
Polar Surface Area 269.96
LOGP Value -1.55      (Computed with XLOGP3)
-3.58      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 14
No. of Nitrogen and Oxygen Atoms: 15
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): P80188  
Entrez Gene IDNCBI Entrez Gene ID: 3934  
ASDInformation of known allosteric effects of PDB entries
 
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