Ki Summary new BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetE3 SUMO-protein ligase CBX4
LigandBDBM50194470
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1616630
IC50>60000±n/a nM
Citation Stuckey JISimpson CNorris-Drouin JLCholensky SHLee JPasca RCheng NDickson BMPearce KHFrye SVJames LI Structure-Activity Relationships and Kinetic Studies of Peptidic Antagonists of CBX Chromodomains. J Med Chem 59:8913-8923 (2016) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
E3 SUMO-protein ligase CBX4
Name:E3 SUMO-protein ligase CBX4
Synonyms:6.3.2.- | CBX4 | Chromobox protein homolog 4 | Pc2 | Polycomb 2 homolog | hPc2
Type:PROTEIN
Mol. Mass.:61401.05
Organism:Homo sapiens (Human)
Description:ChEMBL_108273
Residue:560
Sequence:
MELPAVGEHVFAVESIEKKRIRKGRVEYLVKWRGWSPKYNTWEPEENILDPRLLIAFQNR
ERQEQLMGYRKRGPKPKPLVVQVPTFARRSNVLTGLQDSSTDNRAKLDLGAQGKGQGHQY
ELNSKKHHQYQPHSKERAGKPPPPGKSGKYYYQLNSKKHHPYQPDPKMYDLQYQGGHKEA
PSPTCPDLGAKSHPPDKWAQGAGAKGYLGAVKPLAGAAGAPGKGSEKGPPNGMMPAPKEA
VTGNGIGGKMKIVKNKNKNGRIVIVMSKYMENGMQAVKIKSGEVAEGEARSPSHKKRAAD
ERHPPADRTFKKAAGAEEKKVEAPPKRREEEVSGVSDPQPQDAGSRKLSPTKEAFGEQPL
QLTTKPDLLAWDPARNTHPPSHHPHPHPHHHHHHHHHHHHAVGLNLSHVRKRCLSETHGE
REPCKKRLTARSISTPTCLGGSPAAERPADLPPAAALPQPEVILLDSDLDEPIDLRCVKT
RSEAGEPPSSLQVKPETPASAAVAVAAAAAPTTTAEKPPAEAQDEPAESLSEFKPFFGNI
IITDVTANCLTVTFKEYVTV
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50194470
n/a
NameBDBM50194470
Synonyms:CHEMBL3982833
TypeSmall organic molecule
Emp. Form.C47H67N7O9
Mol. Mass.874.0764
SMILESCOC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC1C2CC3CC(C2)CC1C3)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1 |r,wU:42.45,29.32,4.4,wD:37.40,10.10,TLB:15:16:18:22.20.21,THB:20:19:16:22.21.23,20:21:18.19.25:16,23:21:18:25.24.16,23:24:18:22.20.21,(31.33,-35.94,;29.99,-35.18,;28.66,-35.95,;28.66,-37.5,;27.32,-35.19,;27.32,-33.65,;28.65,-32.87,;25.99,-35.96,;24.66,-35.2,;24.65,-33.66,;23.32,-35.97,;23.33,-37.51,;24.67,-38.28,;24.67,-39.82,;26.01,-40.59,;26.01,-42.12,;27.35,-42.89,;27.36,-44.37,;26.16,-45.65,;27.66,-45.23,;29.07,-45.8,;30.08,-44.52,;28.69,-44.86,;30.09,-42.99,;28.7,-42.41,;27.66,-43.65,;21.99,-35.21,;20.66,-35.99,;20.66,-37.53,;19.32,-35.22,;19.31,-33.68,;20.65,-32.91,;20.64,-31.37,;21.98,-33.67,;17.99,-36,;16.65,-35.23,;16.65,-33.69,;15.32,-36.01,;15.33,-37.55,;13.99,-35.24,;12.66,-36.02,;12.66,-37.56,;11.32,-35.25,;11.31,-33.71,;10.55,-32.36,;11.35,-31.04,;10.59,-29.7,;9.05,-29.69,;8.27,-31.02,;9.03,-32.36,;9.99,-36.03,;8.65,-35.26,;8.65,-33.72,;7.32,-36.04,;5.98,-35.27,;4.65,-36.05,;4.66,-37.59,;3.32,-35.28,;3.32,-33.74,;1.98,-32.97,;.65,-33.75,;.66,-35.3,;2,-36.05,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: