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: 4k55
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4f9lRCSB PDB    PDBbind220aa, >4F9L_1|Chains... *
4f9pRCSB PDB    PDBbind220aa, >4F9P_1|Chains... at 100%
4jkwRCSB PDB    PDBbind124aa, >4JKW_1|Chain... at 91%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
6j0kRCSB PDB    PDBbindH6P
6j0gRCSB PDB    PDBbindH6P
5zxkRCSB PDB    PDBbindH6P
Entry Information
PDB ID4k55
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameButyrophilin subfamily 3 member A1
Ligand NameH6P
EC.Number E.C.-.-.-.-
Resolution 1.91(Å)
Affinity (Kd/Ki/IC50)Kd=3.06uM
Release Year2013
Protein/NA SequenceCheck fasta file
Primary Reference (2013) Nat.Immunol. Vol. 14: pp. 908-916
Ligand Properties
Formula C5H16O8P2
Molecular Weight 266.123
Exact Mass 266.032
No. of atoms 31
No. of bonds 30
Polar Surface Area 167.02
LOGP Value -2.43      (Computed with XLOGP3)
-0.65      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 8
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): O00481  
Entrez Gene IDNCBI Entrez Gene ID: 11119  
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