Display Options: Structure:  




Goto PDB code:

3D presentation of molecule is powered by 3Dmol, which supports all modern browsers and mobile devices via WebGL.

           
Hold mouse button: left to rotate,middle to shift,right to zoom

Related entries of code: 1xt8
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1ssqRCSB PDB    PDBbindCYS
2ylnRCSB PDB    PDBbindCYS

Entry Information
PDB ID1xt8
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Nameputative amino-acid transporter
Ligand NameCYS
EC.Number E.C.-.-.-.-
Resolution 2(Å)
Affinity (Kd/Ki/IC50)Kd=0.14uM
Release Year2005
Protein/NA SequenceCheck fasta file
Primary ReferenceMol.Microbiol. v57 pp. 143-55, 2005
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 likenessNo. 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): Q0P9S0  
Entrez Gene IDNCBI Entrez Gene ID: 905273  
ASDInformation of known allosteric effects of PDB entries

 
This site has been visited times since Nov 2007.


Address: LingLing Road 345, Shanghai, 200032, China      ICP NO: Shanghai-05005485-2
Group Leader: wangrx@mail.sioc.ac.cn      Tel: +86-21-54925128      Webmaster: liuhai@mail.sioc.ac.cn
Copyright ©2007-2019    Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences