MolNFT v1 · #101418 · protein

Crystal structure of the bromodomain of human BRD9 in complex with a triazolo-phthalazine ligand

4NQN · Bromodomain-containing protein 9: “Crystal structure of the bromodomain of human BRD9 in complex with a triazolo-phthalazine ligand”. X-ray diffraction, 1 ligand (Y1Z), 1 pocket (best druggability 0.50). MolNFT v1 #101418 on…

PDB: 4NQN
Type: protein
Length: 113 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Bromodomain-containing protein 9
UniProt: C9JBY0
Ligands: Y1Z
Pockets: 1 · best druggability 0.50

Structure

x-ray diffraction · 1 distinct chain · 62% helix, 0% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Bromodomain-containing protein 9	protein	113	62% helix, 0% strand	C9JBY0

Ligands and binding sites

Y1Z · 2-chloro-N-[5-(3-methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)-2-(morpholin-4-yl)phenyl]benzenesulfonamide · ligand · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	78	0.50	0.83	18	Y1Z

Compared structures

4NQN · Crystal Structure of the bromodomain of human BRD9 in complex with a triazolo-phthalazine… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt C9JBY0
Elsewhere: RCSB PDB 4NQN · PDBe 4NQN · UniProt C9JBY0

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.