6TIA

IRAK4 IN COMPLEX WITH inhibitor

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000287	molecular_function	magnesium ion binding
A	0004672	molecular_function	protein kinase activity
A	0004674	molecular_function	protein serine/threonine kinase activity
A	0005524	molecular_function	ATP binding
A	0006468	biological_process	protein phosphorylation
A	0007165	biological_process	signal transduction
B	0000287	molecular_function	magnesium ion binding
B	0004672	molecular_function	protein kinase activity
B	0004674	molecular_function	protein serine/threonine kinase activity
B	0005524	molecular_function	ATP binding
B	0006468	biological_process	protein phosphorylation
B	0007165	biological_process	signal transduction

Functional Information from PDB Data

site_id	AC1
Number of Residues	14
Details	binding site for residue ND2 A 501

Chain	Residue
A	MET192
A	GLY268
A	ASP278
A	THR280
A	LEU318
A	SER328
A	GLY193
A	VAL200
A	ALA211
A	TYR262
A	VAL263
A	TYR264
A	MET265
A	PRO266

---

site_id	AC2
Number of Residues	7
Details	binding site for residue ND2 A 502

Chain	Residue
A	PHE230
A	ASP231
A	LYS235
A	ALA238
A	PHE251
A	SER253
A	ND2503

---

site_id	AC3
Number of Residues	2
Details	binding site for residue ND2 A 503

Chain	Residue
A	ND2502
A	ND2504

---

site_id	AC4
Number of Residues	3
Details	binding site for residue ND2 A 504

Chain	Residue
A	ASN206
A	ND2503
A	ND2505

---

site_id	AC5
Number of Residues	2
Details	binding site for residue ND2 A 505

Chain	Residue
A	ND2504
B	ND2505

---

site_id	AC6
Number of Residues	15
Details	binding site for residue ND2 B 501

Chain	Residue
B	MET192
B	GLY193
B	ALA211
B	TYR262
B	VAL263
B	TYR264
B	MET265
B	PRO266
B	GLY268
B	ARG273
B	THR280
B	LEU318
B	SER328
B	HOH625
B	HOH648

---

site_id	AC7
Number of Residues	9
Details	binding site for residue ND2 B 502

Chain	Residue
B	LYS227
B	PHE230
B	ASP231
B	ILE234
B	LYS235
B	ALA238
B	PHE251
B	SER253
B	ND2503

---

site_id	AC8
Number of Residues	2
Details	binding site for residue ND2 B 503

Chain	Residue
B	ND2502
B	ND2504

---

site_id	AC9
Number of Residues	3
Details	binding site for residue ND2 B 504

Chain	Residue
A	ASN175
B	ND2503
B	ND2505

---

site_id	AD1
Number of Residues	6
Details	binding site for residue ND2 B 505

Chain	Residue
A	GLU172
A	TYR204
A	ASN206
A	ASN207
A	ND2505
B	ND2504

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	Active site: {"description":"Proton acceptor","evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	16
Details	Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	10
Details	Binding site: {}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	2
Details	Modified residue: {"description":"Phosphothreonine","evidences":[{"source":"PubMed","id":"17161373","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"17312103","evidenceCode":"ECO:0000269"},{"source":"Reference","evidenceCode":"ECO:0000269","citation":{"citationType":"submission","publicationDate":"DEC-2006","submissionDatabase":"PDB data bank","title":"Crystal structures of the apo and inhibited IRAK4 kinase domain.","authors":["Mol C.D.","Arduini R.M.","Baker D.P.","Chien E.Y.","Dougan D.R.","Friedman J.","Gibaja V.","Hession C.A.","Horne A."]}}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI5
Number of Residues	2
Details	Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"17161373","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"17312103","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---