PDBsum entry 4a9n

Signaling protein/inhibitor

PDB id: 4a9n

Contents

Protein chains

112 a.a.

106 a.a.

Ligands

EDO ×6

A9N ×2

SO4 ×4

DMS

Waters ×281

PDB id:

4a9n

Name:

Signaling protein/inhibitor

Title:

N-terminal bromodomain of human brd2 with n-cyclopropyl-5-(3,5- dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonamide

Structure:

Bromodomain containing 2. Chain: a, b, c. Fragment: n-terminal bromodomain (bd1), residues 67-200. Synonym: human brd2. Engineered: yes

Source:

Homo sapiens. Human. Organism_taxid: 9606. Expressed in: escherichia coli. Expression_system_taxid: 562

Resolution:

1.85Å R-factor: 0.175 R-free: 0.195

Authors:

C.Chung,P.Bamborough

Key ref:

P.Bamborough et al. (2012). Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides. J Med Chem, 55, 587-596. PubMed id: 22136469

Date:

26-Nov-11 Release date: 08-Feb-12

Protein chains

P25440  (BRD2_HUMAN) -  Bromodomain-containing protein 2 from Homo sapiens

Seq: 801 a.a.

Struc: 112 a.a.

Protein chain

P25440  (BRD2_HUMAN) -  Bromodomain-containing protein 2 from Homo sapiens

Seq: 801 a.a.

Struc: 106 a.a.

Enzyme reactions

• Enzyme class: Chains A, B, C: E.C.?

J Med Chem 55:587-596 (2012)

PubMed id: 22136469

Fragment-based discovery of bromodomain inhibitors part 2: optimization of phenylisoxazole sulfonamides.

P.Bamborough, H.Diallo, J.D.Goodacre, L.Gordon, A.Lewis, J.T.Seal, D.M.Wilson, M.D.Woodrow, C.W.Chung.

ABSTRACT

No abstract given.