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: 4pnu
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3d1eRCSB PDB    PDBbind366aa, >3D1E_1|Chains... at 100%
3d1fRCSB PDB    PDBbind366aa, >3D1F_1|Chains... at 100%
3d1gRCSB PDB    PDBbind366aa, >3D1G_1|Chains... at 100%
3q4jRCSB PDB    PDBbind366aa, >3Q4J_1|Chains... at 100%
3q4kRCSB PDB    PDBbind366aa, >3Q4K_1|Chains... at 100%
3q4lRCSB PDB    PDBbind368aa, >3Q4L_1|Chains... *
3qsbRCSB PDB    PDBbind366aa, >3QSB_2|Chain... at 100%
4k3kRCSB PDB    PDBbind366aa, >4K3K_1|Chains... at 100%
4k3lRCSB PDB    PDBbind366aa, >4K3L_1|Chains... at 100%
4k3mRCSB PDB    PDBbind366aa, >4K3M_1|Chains... at 100%
4k3oRCSB PDB    PDBbind366aa, >4K3O_1|Chains... at 100%
4k3pRCSB PDB    PDBbind366aa, >4K3P_1|Chains... at 100%
4k3qRCSB PDB    PDBbind366aa, >4K3Q_1|Chains... at 100%
4k3rRCSB PDB    PDBbind366aa, >4K3R_1|Chains... at 100%
4mjpRCSB PDB    PDBbind366aa, >4MJP_1|Chains... at 100%
4mjqRCSB PDB    PDBbind366aa, >4MJQ_1|Chains... at 100%
4mjrRCSB PDB    PDBbind366aa, >4MJR_1|Chains... at 100%
4n98RCSB PDB    PDBbind366aa, >4N98_1|Chains... at 100%
4n99RCSB PDB    PDBbind366aa, >4N99_1|Chains... at 100%
4n9aRCSB PDB    PDBbind366aa, >4N9A_1|Chains... at 100%
4ovfRCSB PDB    PDBbind366aa, >4OVF_1|Chains... at 100%
4ovgRCSB PDB    PDBbind366aa, >4OVG_1|Chains... at 100%
4ovhRCSB PDB    PDBbind366aa, >4OVH_1|Chains... at 100%
4pnwRCSB PDB    PDBbind366aa, >4PNW_1|Chains... at 100%
6fvmRCSB PDB    PDBbind368aa, >6FVM_1|Chains... at 99%
6fvlRCSB PDB    PDBbind368aa, >6FVL_1|Chains... 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 ID4pnu
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameE. coli sliding clamp
Ligand Name2VD
EC.Number E.C.2.7.7.7
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Kd=13uM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2015) J.Med.Chem. Vol. 58: pp. 4693-4702
Ligand Properties
Formula C24H23BrN2O5
Molecular Weight 499.354
Exact Mass 498.079
No. of atoms 55
No. of bonds 58
Polar Surface Area 108.63
LOGP Value 6.03      (Computed with XLOGP3)
3.80      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 7
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 ACNo matched UniProt accession number (AC) found!
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
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