Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T15745 | Target Info | |||
| Target Name | Bromodomain adjacent to zinc finger 2B (BAZ2B) | ||||
| Synonyms | hWALp4; KIAA1476; Bromodomain adjacent to zinc finger domain protein 2B | ||||
| Target Type | Literature-reported Target | ||||
| Gene Name | BAZ2B | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | N-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carboxamide | Ligand Info | |||
| Canonical SMILES | CNC(=O)C1=C2C(=CS1)OCCO2 | ||||
| InChI | 1S/C8H9NO3S/c1-9-8(10)7-6-5(4-13-7)11-2-3-12-6/h4H,2-3H2,1H3,(H,9,10) | ||||
| InChIKey | MXUQWUJJYQPEJH-UHFFFAOYSA-N | ||||
| PubChem Compound ID | 24229806 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 4NRC Crystal Structure of the bromodomain of human BAZ2B in complex with compound-3 N01186 | ||||||
| Method | X-ray diffraction | Resolution | 1.86 Å | Mutation | No | [1] |
| PDB Sequence |
SMSVKKPKRD
1865 DSKDLALCSM1875 ILTEMETHED1885 AWPFLLPVNL1895 KLVPGYKKVI1905 KKPMDFSTIR 1915 EKLSSGQYPN1925 LETFALDVRL1935 VFDNCETFNE1945 DDSDIGRAGH1955 NMRKYFEKKW 1965 TDTFK
|
|||||
|
|
||||||
| PDB ID: 5CQA Crystal structure of the bromodomain of bromodomain adjacent to zinc finger domain protein 2B (BAZ2B) in complex with N-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carboxamide (SGC - Diamond I04-1 fragment screening) | ||||||
| Method | X-ray diffraction | Resolution | 2.13 Å | Mutation | No | [2] |
| PDB Sequence |
SMSVKKPKRD
1865 DSKDLALCSM1875 ILTEMETHED1885 AWPFLLPVNL1895 KLVPGYKKVI1905 KKPMDFSTIR 1915 EKLSSGQYPN1925 LETFALDVRL1935 VFDNCETFNE1945 DDSDIGRAGH1955 NMRKYFEKKW 1965 TDTFK
|
|||||
|
|
||||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Targeting low-druggability bromodomains: fragment based screening and inhibitor design against the BAZ2B bromodomain. J Med Chem. 2013 Dec 27;56(24):10183-7. | ||||
| REF 2 | Crystal structure of the second bromodomain of bromodomain adjancent to zinc finger domain protein 2B (BAZ2B) in complex with N-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carboxamide (SGC - Diamond I04-1 fragment screening) | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.