6MH7

Crystal structure of the first bromodomain of human BRD4 in complex with SKT-68, a 1,4,5-trisubstituted imidazole analogue

Functional Information from PDB Data

site_id	AC1
Number of Residues	14
Details	binding site for residue JQY A 201

Chain	Residue
A	TRP81
A	HOH340
A	HOH344
A	HOH369
B	ASP145
B	JQY201
A	PRO82
A	PHE83
A	LEU92
A	TYR97
A	MET132
A	CYS136
A	ASN140
A	HOH307

---

site_id	AC2
Number of Residues	6
Details	binding site for residue DMS A 202

Chain	Residue
A	GLU49
A	ARG113
A	HOH302
B	ARG58
B	GLU167
B	HOH348

---

site_id	AC3
Number of Residues	5
Details	binding site for residue EDO A 203

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

---

site_id	AC4
Number of Residues	4
Details	binding site for residue EDO A 204

Chain	Residue
A	LEU71
A	LYS72
A	HOH321
A	HOH337

---

site_id	AC5
Number of Residues	11
Details	binding site for residue JQY B 201

Chain	Residue
A	ASP145
A	JQY201
B	TRP81
B	PRO82
B	PHE83
B	LEU92
B	TYR97
B	MET132
B	ASN140
B	HOH326
B	HOH366

---

site_id	AC6
Number of Residues	7
Details	binding site for residue EDO B 202

Chain	Residue
A	ASN116
B	ILE100
B	ILE101
B	LYS102
B	THR103
B	ASN135
B	HOH319

---

site_id	AC7
Number of Residues	1
Details	binding site for residue EDO B 203

Chain	Residue
B	TRP81

---

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

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Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	SITE: Acetylated histone binding => ECO:0000269|PubMed:22464331

Chain	Residue	Details
A	ASN140
B	ASN140

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site_id	SWS_FT_FI2
Number of Residues	4
Details	CROSSLNK: Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO2) => ECO:0007744|PubMed:28112733

Chain	Residue	Details
A	LYS99
B	LYS99

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