5F60

Crystal structure of the first bromodomain of human BRD4 in complex with SG3-014

Functional Information from PDB Data

site_id	AC1
Number of Residues	11
Details	binding site for residue 5VZ A 201

Chain	Residue
A	TRP81
A	HOH311
A	HOH394
A	PRO82
A	PHE83
A	VAL87
A	LYS99
A	ASN140
A	ASP145
A	ILE146
A	EDO204

---

site_id	AC2
Number of Residues	9
Details	binding site for residue PEG A 202

Chain	Residue
A	THR134
A	TYR137
A	LEU156
A	GLN159
A	LYS160
A	GLU163
A	HOH309
A	HOH312
A	HOH314

---

site_id	AC3
Number of Residues	7
Details	binding site for residue EDO A 203

Chain	Residue
A	ILE100
A	ILE101
A	LYS102
A	THR103
A	ASN135
A	HOH388
A	HOH397

---

site_id	AC4
Number of Residues	8
Details	binding site for residue EDO A 204

Chain	Residue
A	PRO86
A	ASP88
A	LYS91
A	ASP96
A	5VZ201
A	HOH402
A	HOH433
A	HOH438

---

site_id	AC5
Number of Residues	4
Details	binding site for residue EDO A 205

Chain	Residue
A	GLY143
A	VAL147
A	GLU151
A	HOH306

---

Functional Information from PROSITE/UniProt

site_id	PS00633
Number of Residues	60
Details	BROMODOMAIN_1 Bromodomain signature. AwpFqqpvDavklnlpDYYkiIktpMdmgtIkkrlenny..Ywnaqeciqdfnt.MftNCyiY

Chain	Residue	Details
A	ALA80-TYR139

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	106
Details	Domain: {"description":"Bromo 1","evidences":[{"source":"PROSITE-ProRule","id":"PRU00035","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	1
Details	Site: {"description":"Acetylated histone binding","evidences":[{"source":"PubMed","id":"22464331","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	2
Details	Cross-link: {"description":"Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO2)","evidences":[{"source":"PubMed","id":"28112733","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---