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: 6eab
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3ebhRCSB PDB    PDBbind889aa, >3EBH_1|Chain... at 100%
3ebiRCSB PDB    PDBbind890aa, >3EBI_1|Chain... at 100%
3q43RCSB PDB    PDBbind891aa, >3Q43_1|Chain... at 99%
3q44RCSB PDB    PDBbind891aa, >3Q44_1|Chain... at 99%
3t8vRCSB PDB    PDBbind895aa, >3T8V_1|Chain... at 99%
4k5lRCSB PDB    PDBbind898aa, >4K5L_1|Chain... at 99%
4k5mRCSB PDB    PDBbind898aa, >4K5M_1|Chain... at 99%
4k5nRCSB PDB    PDBbind895aa, >4K5N_1|Chain... at 99%
4k5oRCSB PDB    PDBbind895aa, >4K5O_1|Chain... at 99%
4k5pRCSB PDB    PDBbind895aa, >4K5P_1|Chain... at 99%
4r5tRCSB PDB    PDBbind896aa, >4R5T_1|Chain... at 99%
4r5vRCSB PDB    PDBbind895aa, >4R5V_1|Chain... at 99%
4r5xRCSB PDB    PDBbind903aa, >4R5X_1|Chain... *
4zqtRCSB PDB    PDBbind889aa, >4ZQT_1|Chain... at 100%
4zw3RCSB PDB    PDBbind890aa, >4ZW3_1|Chain... at 100%
4zw5RCSB PDB    PDBbind890aa, >4ZW5_1|Chain... at 100%
4zw6RCSB PDB    PDBbind890aa, >4ZW6_1|Chain... at 100%
4zw7RCSB PDB    PDBbind890aa, >4ZW7_1|Chain... at 100%
4zw8RCSB PDB    PDBbind890aa, >4ZW8_1|Chain... at 100%
4zx3RCSB PDB    PDBbind890aa, >4ZX3_1|Chain... at 100%
4zx4RCSB PDB    PDBbind890aa, >4ZX4_1|Chain... at 100%
4zx5RCSB PDB    PDBbind890aa, >4ZX5_1|Chain... at 100%
4zx6RCSB PDB    PDBbind890aa, >4ZX6_1|Chain... at 100%
6ea1RCSB PDB    PDBbind889aa, >6EA1_1|Chain... at 100%
6ea2RCSB PDB    PDBbind889aa, >6EA2_1|Chain... at 100%
6eaaRCSB PDB    PDBbind889aa, >6EAA_1|Chain... at 100%
6ee3RCSB PDB    PDBbind889aa, >6EE3_1|Chain... at 100%
6ee4RCSB PDB    PDBbind889aa, >6EE4_1|Chain... at 100%
6ee6RCSB PDB    PDBbind889aa, >6EE6_1|Chain... at 100%
6eedRCSB PDB    PDBbind889aa, >6EED_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID6eab
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NamePf-M1
Ligand NameJ2D
EC.Number E.C.3.4.11.-
Resolution 1.85(Å)
Affinity (Kd/Ki/IC50)Ki=431nM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) J. Med. Chem. Vol.62 : pp. 622-640
Ligand Properties
Formula C20H19F3N2O4
Molecular Weight 408.371
Exact Mass 408.130
No. of atoms 48
No. of bonds 50
Polar Surface Area 87.66
LOGP Value 2.33      (Computed with XLOGP3)
3.64      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 3
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): O96935  
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 ©2007-2025    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