Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T35809 | Target Info | |||
| Target Name | Bromodomain-containing protein 1 (BRD1) | ||||
| Synonyms | Bromodomain and PHD finger-containing protein 2; BRPF2; BRL; BR140-like protein | ||||
| Target Type | Literature-reported Target | ||||
| Gene Name | BRD1 | ||||
| Biochemical Class | Bromodomain | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | N-Methylthieno[2,3-B]pyridine-2-Carboxamide | Ligand Info | |||
| Canonical SMILES | CNC(=O)C1=CC2=C(S1)N=CC=C2 | ||||
| InChI | 1S/C9H8N2OS/c1-10-8(12)7-5-6-3-2-4-11-9(6)13-7/h2-5H,1H3,(H,10,12) | ||||
| InChIKey | UKSXMWMDJAZHOM-UHFFFAOYSA-N | ||||
| PubChem Compound ID | 124220767 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 5POV PanDDA analysis group deposition -- Crystal Structure of BRD1 in complex with N11063a | ||||||
| Method | X-ray diffraction | Resolution | 1.57 Å | Mutation | Yes | [1] |
| PDB Sequence |
SMEQVAMELR
31 LTELTRLLRS41 VLDQLQDKDP51 ARIFAQPVSL61 KEVPDYLDHI71 KHPMDFATMR 81 KRLEAQGYKN91 LHEFEEDFDL101 IIDNCMKYNA111 RDTVFYRAAV121 RLRDQGGVVL 131 RQARREVDSI141 G
|
|||||
|
|
||||||
| PDB ID: 5POG PanDDA analysis group deposition -- Crystal Structure of BRD1 in complex with N11063a | ||||||
| Method | X-ray diffraction | Resolution | 1.77 Å | Mutation | Yes | [1] |
| PDB Sequence |
SMEQVAMELR
31 LTELTRLLRS41 VLDQLQDKDP51 ARIFAQPVSL61 KEVPDYLDHI71 KHPMDFATMR 81 KRLEAQGYKN91 LHEFEEDFDL101 IIDNCMKYNA111 RDTVFYRAAV121 RLRDQGGVVL 131 RQARREVD
|
|||||
|
|
||||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | A multi-crystal method for extracting obscured crystallographic states from conventionally uninterpretable electron density. Nat Commun. 2017 Apr 24;8:15123. | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.