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Related entries of code: 1w31
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1ylvRCSB PDB    PDBbind342aa, >1YLV_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1w31
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameaminolevulinic acid dehydratase
Ligand NameSHO
EC.Number E.C.4.2.1.24
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Ki=0.25mM
Release Year2005
Protein/NA SequenceCheck fasta file
Primary Reference Acta Crystallogr.,Sect.Dv61;pp.1222
Ligand Properties
Formula C5H10O3
Molecular Weight 118.131
Exact Mass 118.063
No. of atoms 18
No. of bonds 17
Polar Surface Area 57.53
LOGP Value 1.20      (Computed with XLOGP3)
0.23      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
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): P05373  
Entrez Gene IDNCBI Entrez Gene ID: 852842  
ASDInformation of known allosteric effects of PDB entries

 
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