Browse entries in the PDBbind-CN Database

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Related entries of code: 6bau
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2nwlRCSB PDB    PDBbind422aa, >2NWL_1|Chains... *
2nwwRCSB PDB    PDBbind422aa, >2NWW_1|Chains... at 99%
4izmRCSB PDB    PDBbind421aa, >4IZM_1|Chains... at 99%
4x2sRCSB PDB    PDBbind422aa, >4X2S_1|Chains... at 99%
6bmiRCSB PDB    PDBbind420aa, >6BMI_1|Chains... at 97%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1ssqRCSB PDB    PDBbindCYS
1xt8RCSB PDB    PDBbindCYS
2ylnRCSB PDB    PDBbindCYS
6nu5RCSB PDB    PDBbindCYS
6nu1RCSB PDB    PDBbindCYS
6a80RCSB PDB    PDBbindCYS
Entry Information
PDB ID6bau
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameGltPh
Ligand NameCYS
EC.Number E.C.-.-.-.-
Resolution 3.8(Å)
Affinity (Kd/Ki/IC50)Kd=31uM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) Nat Commun Vol. 9: pp. 38-38
Ligand Properties
Formula C3H8NO2S
Molecular Weight 122.166
Exact Mass 122.028
No. of atoms 15
No. of bonds 14
Polar Surface Area 103.74
LOGP Value -2.19      (Computed with XLOGP3)
-1.39      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
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): O59010  
Entrez Gene IDNCBI Entrez Gene ID: 1443616  
ASDInformation of known allosteric effects of PDB entries
 
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