Browse entries in the PDBbind-CN Database

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: 2ao6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1osvRCSB PDB    PDBbind12aa, >1OSV:E|PDBID|CHAIN|... at 100%
1p93RCSB PDB    PDBbind12aa, >1P93:H|PDBID|CHAIN|... at 100%
1t63RCSB PDB    PDBbind14aa, >1T63:B|PDBID|CHAIN|... at 100%
3k22RCSB PDB    PDBbind12aa, >3K22:H|PDBID|CHAIN|... at 100%
3k23RCSB PDB    PDBbind12aa, >3K23:F|PDBID|CHAIN|... at 100%
3l0eRCSB PDB    PDBbind12aa, >3L0E:B|PDBID|CHAIN|... at 100%
4csjRCSB PDB    PDBbind13aa, >4CSJ:B|PDBID|CHAIN|... at 100%
4p6wRCSB PDB    PDBbind12aa, >4P6W:B|PDBID|CHAIN|... at 91%
4p6xRCSB PDB    PDBbind14aa, >4P6X:L|PDBID|CHAIN|... at 100%
5h1eRCSB PDB    PDBbind13aa, >5H1E:C|PDBID|CHAIN|... at 100%
5ickRCSB PDB    PDBbind11aa, >5ICK:D|PDBID|CHAIN|... at 100%
5q17RCSB PDB    PDBbind12aa, >5Q17:B|PDBID|CHAIN|... at 100%
5xplRCSB PDB    PDBbind13aa, >5XPL:C|PDBID|CHAIN|... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1e3gRCSB PDB    PDBbindR18
1xowRCSB PDB    PDBbindR18

Entry Information
PDB ID2ao6
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameandrogen receptor
Ligand NameR18
EC.Number E.C.-.-.-.-
Resolution 1.89(Å)
Affinity (Kd/Ki/IC50)Kd=0.52nM
Release Year2005
Protein/NA SequenceCheck fasta file
Primary Reference Mol. Cell v16 pp. 425-38, 2004
Ligand Properties
Formula C19H24O2
Molecular Weight 284.393
Exact Mass 284.178
No. of atoms 45
No. of bonds 48
Polar Surface Area 37.3
LOGP Value 2.08      (Computed with XLOGP3)
3.72      (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: 2
No. of Rings: 4
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): P10275  Q15596  
Entrez Gene IDNCBI Entrez Gene ID: 367  10499  
ASDInformation of known allosteric effects of PDB entries

 
This site has been visited times since Nov 2007.


Copyright ©2007-2021    涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃    缃戠珯澶囨鍙凤細娌狪CP澶2021015625鍙-3    娌叕瀹夊妗堝彿锛姝e湪鐢宠涓


Technical Support锛堟妧鏈敮鎸侊級: yingsaisi@foxmail.com