4WNP

Structure of ULK1 bound to a potent inhibitor

Functional Information from GO Data

Chain	GOid	namespace	contents
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	0010506	biological_process	regulation of autophagy
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	0010506	biological_process	regulation of autophagy
C	0004672	molecular_function	protein kinase activity
C	0004674	molecular_function	protein serine/threonine kinase activity
C	0005524	molecular_function	ATP binding
C	0006468	biological_process	protein phosphorylation
C	0010506	biological_process	regulation of autophagy
D	0004672	molecular_function	protein kinase activity
D	0004674	molecular_function	protein serine/threonine kinase activity
D	0005524	molecular_function	ATP binding
D	0006468	biological_process	protein phosphorylation
D	0010506	biological_process	regulation of autophagy

Functional Information from PDB Data

site_id	AC1
Number of Residues	5
Details	binding site for residue GOL A 301

Chain	Residue
A	HIS130
A	ILE134
A	ILE135
A	LEU172
A	PHE269

---

site_id	AC2
Number of Residues	7
Details	binding site for residue GOL A 302

Chain	Residue
A	HOH462
B	SER131
B	GLY133
A	HIS130
A	SER131
A	GLY133
A	LEU172

---

site_id	AC3
Number of Residues	13
Details	binding site for residue 3RJ A 303

Chain	Residue
A	ILE22
A	ALA44
A	GLU93
A	TYR94
A	CYS95
A	ASN96
A	GLY98
A	ASP102
A	GLN142
A	ASN143
A	LEU145
A	HOH425
A	HOH460

---

site_id	AC4
Number of Residues	10
Details	binding site for residue 3RJ B 401

Chain	Residue
B	ILE22
B	ALA44
B	GLU93
B	TYR94
B	CYS95
B	GLY98
B	ASP99
B	GLN142
B	ASN143
B	LEU145

---

site_id	AC5
Number of Residues	11
Details	binding site for residue 3RJ C 401

Chain	Residue
C	ILE22
C	ALA44
C	GLU93
C	TYR94
C	CYS95
C	ASN96
C	GLY98
C	ASP102
C	GLN142
C	ASN143
C	LEU145

---

site_id	AC6
Number of Residues	12
Details	binding site for residue 3RJ D 401

Chain	Residue
D	ILE22
D	ALA44
D	LYS46
D	GLU93
D	TYR94
D	CYS95
D	GLY98
D	ASP99
D	GLN142
D	ASN143
D	LEU145
D	HOH539

---

Functional Information from PROSITE/UniProt

site_id	PS00107
Number of Residues	25
Details	PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. IGHGAFAVVFkGrhraahdle.........VAVK

Chain	Residue	Details
A	ILE22-LYS46

---

site_id	PS00108
Number of Residues	13
Details	PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. IiHrDLKpqNILL

Chain	Residue	Details
A	ILE134-LEU146

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	4
Details	Active site: {"description":"Proton acceptor","evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"},{"source":"PROSITE-ProRule","id":"PRU10027","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	32
Details	Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	4
Details	Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"20921139","evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	4
Details	Modified residue: {"description":"N6-acetyllysine","evidences":[{"source":"UniProtKB","id":"O70405","evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

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