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: 6ep4
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2wigRCSB PDB    PDBbind529aa, >2WIG_1|Chain... at 99%
2wijRCSB PDB    PDBbind529aa, >2WIJ_1|Chain... at 99%
2wikRCSB PDB    PDBbind529aa, >2WIK_1|Chain... at 99%
4bdsRCSB PDB    PDBbind529aa, >4BDS_1|Chain... at 99%
4tpkRCSB PDB    PDBbind602aa, >4TPK_1|Chains... *
4xiiRCSB PDB    PDBbind544aa, >4XII_1|Chains... at 100%
5dytRCSB PDB    PDBbind530aa, >5DYT_1|Chains... at 100%
5dywRCSB PDB    PDBbind530aa, >5DYW_1|Chains... at 100%
5dyyRCSB PDB    PDBbind530aa, >5DYY_1|Chains... at 100%
5k5eRCSB PDB    PDBbind529aa, >5K5E_1|Chains... at 100%
5lkrRCSB PDB    PDBbind574aa, >5LKR_1|Chains... at 100%
5nn0RCSB PDB    PDBbind529aa, >5NN0_1|Chain... at 99%
6eqpRCSB PDB    PDBbind529aa, >6EQP_1|Chain... at 99%
6esjRCSB PDB    PDBbind529aa, >6ESJ_1|Chains... at 100%
6esyRCSB PDB    PDBbind529aa, >6ESY_1|Chains... at 100%
6f7qRCSB PDB    PDBbind529aa, >6F7Q_1|Chains... at 100%
6qaeRCSB PDB    PDBbind557aa, >6QAE_1|Chain... at 99%
6qadRCSB PDB    PDBbind557aa, >6QAD_1|Chain... at 99%
6qacRCSB PDB    PDBbind557aa, >6QAC_1|Chain... at 99%
6qabRCSB PDB    PDBbind557aa, >6QAB_1|Chain... at 99%
6qaaRCSB PDB    PDBbind557aa, >6QAA_1|Chain... at 99%
6i0cRCSB PDB    PDBbind529aa, >6I0C_1|Chain... at 99%
6i0bRCSB PDB    PDBbind529aa, >6I0B_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 ID6ep4
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namebutyrylcholinesterase
Ligand NameDME
EC.Number E.C.-.-.-.-
Resolution 2.3(Å)
Affinity (Kd/Ki/IC50)Ki=4.5uM
Release Year2017
Protein/NA SequenceCheck fasta file
Primary Reference (2017) Molecules Vol. 22: pp. 1-21
Ligand Properties
Formula C16H38N2
Molecular Weight 258.486
Exact Mass 258.303
No. of atoms 56
No. of bonds 55
Polar Surface Area 0
LOGP Value 3.93      (Computed with XLOGP3)
3.52      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 0
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 2
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): P06276  
Entrez Gene IDNCBI Entrez Gene ID: 590  
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