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: 1nax
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1n46RCSB PDB    PDBbind258aa, >1N46_1|Chains... at 100%
1nq0RCSB PDB    PDBbind263aa, >1NQ0_1|Chain... at 98%
1q4xRCSB PDB    PDBbind253aa, >1Q4X_1|Chain... at 100%
1r6gRCSB PDB    PDBbind259aa, >1R6G_1|Chain... at 99%
1xzxRCSB PDB    PDBbind281aa, >1XZX_1|Chain... *
1y0xRCSB PDB    PDBbind281aa, >1Y0X_1|Chain... at 100%
2j4aRCSB PDB    PDBbind253aa, >2J4A_1|Chain... at 99%
3gwsRCSB PDB    PDBbind259aa, >3GWS_1|Chain... at 100%
3imyRCSB PDB    PDBbind261aa, >3IMY_1|Chain... at 100%
3jzcRCSB PDB    PDBbind263aa, >3JZC_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 ID1nax
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameThyroid hormone receptor beta-1
Ligand NameIH5
EC.Number E.C.-.-.-.-
Resolution 2.7(Å)
Affinity (Kd/Ki/IC50)Ki=0.37uM
Release Year2003
Protein/NA SequenceCheck fasta file
Primary Reference (2012) J. Med. Chem., Vol.55, pp.5649-5675
Ligand Properties
Formula C17H16Cl2O4
Molecular Weight 355.213
Exact Mass 354.043
No. of atoms 39
No. of bonds 40
Polar Surface Area 66.76
LOGP Value 6.38      (Computed with XLOGP3)
5.24      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 4
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): P10828  
Entrez Gene IDNCBI Entrez Gene ID: 7068  
ASDInformation of known allosteric effects of PDB entries
 
This site has been visited times since Nov 2007.


Copyright ©2007-2024    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叕缃戝畨澶囷細姝ｅ湪鐢宠涓


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