Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

5HZN

Structure of NVP-AEW541 in complex with IGF-1R kinase

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004672	molecular_function	protein kinase activity
A	0004713	molecular_function	protein tyrosine kinase activity
A	0004714	molecular_function	transmembrane receptor protein tyrosine kinase activity
A	0005524	molecular_function	ATP binding
A	0006468	biological_process	protein phosphorylation
A	0007169	biological_process	cell surface receptor protein tyrosine kinase signaling pathway
A	0016020	cellular_component	membrane
B	0004672	molecular_function	protein kinase activity
B	0004713	molecular_function	protein tyrosine kinase activity
B	0004714	molecular_function	transmembrane receptor protein tyrosine kinase activity
B	0005524	molecular_function	ATP binding
B	0006468	biological_process	protein phosphorylation
B	0007169	biological_process	cell surface receptor protein tyrosine kinase signaling pathway
B	0016020	cellular_component	membrane
C	0004672	molecular_function	protein kinase activity
C	0004713	molecular_function	protein tyrosine kinase activity
C	0004714	molecular_function	transmembrane receptor protein tyrosine kinase activity
C	0005524	molecular_function	ATP binding
C	0006468	biological_process	protein phosphorylation
C	0007169	biological_process	cell surface receptor protein tyrosine kinase signaling pathway
C	0016020	cellular_component	membrane
D	0004672	molecular_function	protein kinase activity
D	0004713	molecular_function	protein tyrosine kinase activity
D	0004714	molecular_function	transmembrane receptor protein tyrosine kinase activity
D	0005524	molecular_function	ATP binding
D	0006468	biological_process	protein phosphorylation
D	0007169	biological_process	cell surface receptor protein tyrosine kinase signaling pathway
D	0016020	cellular_component	membrane
E	0004672	molecular_function	protein kinase activity
E	0004713	molecular_function	protein tyrosine kinase activity
E	0004714	molecular_function	transmembrane receptor protein tyrosine kinase activity
E	0005524	molecular_function	ATP binding
E	0006468	biological_process	protein phosphorylation
E	0007169	biological_process	cell surface receptor protein tyrosine kinase signaling pathway
E	0016020	cellular_component	membrane
F	0004672	molecular_function	protein kinase activity
F	0004713	molecular_function	protein tyrosine kinase activity
F	0004714	molecular_function	transmembrane receptor protein tyrosine kinase activity
F	0005524	molecular_function	ATP binding
F	0006468	biological_process	protein phosphorylation
F	0007169	biological_process	cell surface receptor protein tyrosine kinase signaling pathway
F	0016020	cellular_component	membrane
G	0004672	molecular_function	protein kinase activity
G	0004713	molecular_function	protein tyrosine kinase activity
G	0004714	molecular_function	transmembrane receptor protein tyrosine kinase activity
G	0005524	molecular_function	ATP binding
G	0006468	biological_process	protein phosphorylation
G	0007169	biological_process	cell surface receptor protein tyrosine kinase signaling pathway
G	0016020	cellular_component	membrane
H	0004672	molecular_function	protein kinase activity
H	0004713	molecular_function	protein tyrosine kinase activity
H	0004714	molecular_function	transmembrane receptor protein tyrosine kinase activity
H	0005524	molecular_function	ATP binding
H	0006468	biological_process	protein phosphorylation
H	0007169	biological_process	cell surface receptor protein tyrosine kinase signaling pathway
H	0016020	cellular_component	membrane

Functional Information from PDB Data

site_id	AC1
Number of Residues	15
Details	binding site for residue 66A A 1301

Chain	Residue
A	GLY1003
A	GLU1077
A	MET1079
A	MET1139
A	ASP1150
A	HOH1418
D	ASP982
A	GLN1004
A	GLY1005
A	PHE1007
A	ALA1028
A	LYS1030
A	GLU1047
A	VAL1060
A	MET1076

site_id	AC2
Number of Residues	11
Details	binding site for residue MES A 1302

Chain	Residue
A	SER1006
A	PHE1007
A	GLY1152
A	MET1153
A	ARG1155
A	ASP1156
A	LYS1168
A	GLY1169
A	LEU1170
D	ARG1039
D	TYR1158

site_id	AC3
Number of Residues	7
Details	binding site for residue SO4 A 1303

Chain	Residue
A	ALA1036
A	SER1037
A	MET1038
A	ARG1039
B	GLN1004
B	ASN1033
B	HOH1413

site_id	AC4
Number of Residues	16
Details	binding site for residue 66A B 1301

Chain	Residue
A	ASP982
B	LEU1002
B	GLY1003
B	GLN1004
B	ALA1028
B	LYS1030
B	PHE1044
B	GLU1047
B	VAL1060
B	MET1076
B	GLU1077
B	MET1079
B	ASP1083
B	ARG1136
B	MET1139
B	ASP1150

site_id	AC5
Number of Residues	12
Details	binding site for residue MES B 1302

Chain	Residue
A	ARG1039
B	SER1006
B	PHE1007
B	GLY1152
B	MET1153
B	THR1154
B	ARG1155
B	ASP1156
B	LYS1168
B	GLY1169
B	LEU1170
B	HOH1420

site_id	AC6
Number of Residues	17
Details	binding site for residue 66A C 1301

Chain	Residue
B	ASP982
C	GLY1003
C	GLN1004
C	PHE1007
C	ALA1028
C	LYS1030
C	PHE1044
C	GLU1047
C	VAL1060
C	MET1076
C	GLU1077
C	MET1079
C	ASP1083
C	ARG1136
C	MET1139
C	ASP1150
C	HOH1436

site_id	AC7
Number of Residues	9
Details	binding site for residue MES C 1302

Chain	Residue
B	ARG1039
C	SER1006
C	PHE1007
C	GLY1152
C	MET1153
C	ASP1156
C	LYS1168
C	GLY1169
C	LEU1170

site_id	AC8
Number of Residues	7
Details	binding site for residue SO4 C 1303

Chain	Residue
C	SER1037
C	MET1038
C	ARG1039
C	HOH1418
D	GLN1004
D	GLY1008
D	ASN1033

site_id	AC9
Number of Residues	17
Details	binding site for residue 66A D 1301

Chain	Residue
D	ALA1028
D	LYS1030
D	PHE1044
D	GLU1047
D	VAL1060
D	MET1076
D	GLU1077
D	MET1079
D	MET1139
D	GLY1149
D	ASP1150
D	HOH1463
C	ASP982
D	LEU1002
D	GLY1003
D	GLN1004
D	GLY1005

site_id	AD1
Number of Residues	11
Details	binding site for residue MES D 1302

Chain	Residue
C	ARG1039
C	TYR1158
D	SER1006
D	PHE1007
D	GLY1152
D	MET1153
D	ARG1155
D	ASP1156
D	LYS1168
D	GLY1169
D	LEU1170

site_id	AD2
Number of Residues	16
Details	binding site for residue 66A E 1301

Chain	Residue
E	GLY1003
E	GLN1004
E	GLY1005
E	PHE1007
E	ALA1028
E	LYS1030
E	GLU1047
E	VAL1060
E	MET1076
E	GLU1077
E	MET1079
E	MET1139
E	GLY1149
E	ASP1150
E	HOH1407
H	ASP982

site_id	AD3
Number of Residues	11
Details	binding site for residue MES E 1302

Chain	Residue
E	SER1006
E	PHE1007
E	GLY1152
E	MET1153
E	ARG1155
E	ASP1156
E	LYS1168
E	GLY1169
E	LEU1170
H	ARG1039
H	TYR1158

site_id	AD4
Number of Residues	7
Details	binding site for residue SO4 E 1303

Chain	Residue
E	ALA1036
E	SER1037
E	MET1038
E	ARG1039
E	HOH1434
F	GLN1004
F	ASN1033

site_id	AD5
Number of Residues	16
Details	binding site for residue 66A F 1301

Chain	Residue
E	ASP982
F	LEU1002
F	GLY1003
F	GLN1004
F	ALA1028
F	LYS1030
F	PHE1044
F	GLU1047
F	MET1076
F	GLU1077
F	MET1079
F	ASP1083
F	ARG1136
F	MET1139
F	GLY1149
F	ASP1150

site_id	AD6
Number of Residues	12
Details	binding site for residue MES F 1302

Chain	Residue
E	ARG1039
F	SER1006
F	PHE1007
F	GLY1152
F	MET1153
F	THR1154
F	ARG1155
F	ASP1156
F	LYS1168
F	GLY1169
F	LEU1170
F	HOH1423

site_id	AD7
Number of Residues	17
Details	binding site for residue 66A G 1301

Chain	Residue
F	ASP982
G	LEU1002
G	GLY1003
G	GLN1004
G	ALA1028
G	LYS1030
G	PHE1044
G	GLU1047
G	VAL1060
G	MET1076
G	GLU1077
G	MET1079
G	ASP1083
G	ARG1136
G	MET1139
G	ASP1150
G	HOH1437

site_id	AD8
Number of Residues	9
Details	binding site for residue MES G 1302

Chain	Residue
F	ARG1039
G	SER1006
G	PHE1007
G	GLY1152
G	MET1153
G	ASP1156
G	GLY1169
G	LEU1170
G	HOH1417

site_id	AD9
Number of Residues	7
Details	binding site for residue SO4 G 1303

Chain	Residue
G	SER1037
G	MET1038
G	ARG1039
G	HOH1405
H	GLN1004
H	GLY1008
H	ASN1033

site_id	AE1
Number of Residues	19
Details	binding site for residue 66A H 1301

Chain	Residue
G	ASP982
H	LEU1002
H	GLY1003
H	GLN1004
H	GLY1005
H	ALA1028
H	LYS1030
H	PHE1044
H	GLU1047
H	ALA1048
H	VAL1060
H	MET1076
H	GLU1077
H	MET1079
H	ASP1083
H	MET1139
H	GLY1149
H	ASP1150
H	HOH1453

site_id	AE2
Number of Residues	11
Details	binding site for residue MES H 1302

Chain	Residue
G	ARG1039
G	TYR1158
H	SER1006
H	PHE1007
H	GLY1152
H	MET1153
H	ARG1155
H	ASP1156
H	LYS1168
H	GLY1169
H	LEU1170

Functional Information from PROSITE/UniProt

site_id	PS00107
Number of Residues	29
Details	PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGQGSFGMVYeGvakgvvkdepetr.....VAIK

Chain	Residue	Details
A	LEU1002-LYS1030

site_id	PS00109
Number of Residues	13
Details	PROTEIN_KINASE_TYR Tyrosine protein kinases specific active-site signature. FVHrDLAARNCMV

Chain	Residue	Details
A	PHE1128-VAL1140

site_id	PS00239
Number of Residues	9
Details	RECEPTOR_TYR_KIN_II Receptor tyrosine kinase class II signature. DIYetdYYR

Chain	Residue	Details
A	ASP1156-ARG1164

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	8
Details	ACT_SITE: Proton acceptor => ECO:0000255\|PROSITE-ProRule:PRU00159, ECO:0000255\|PROSITE-ProRule:PRU10028

Chain	Residue	Details
A	ASP1132
B	ASP1132
C	ASP1132
D	ASP1132
E	ASP1132
F	ASP1132
G	ASP1132
H	ASP1132

site_id	SWS_FT_FI2
Number of Residues	8
Details	BINDING: BINDING => ECO:0000255\|PROSITE-ProRule:PRU00159

Chain	Residue	Details
A	LEU1002
B	LEU1002
C	LEU1002
D	LEU1002
E	LEU1002
F	LEU1002
G	LEU1002
H	LEU1002

site_id	SWS_FT_FI3
Number of Residues	8
Details	BINDING:

Chain	Residue	Details
A	LYS1030
B	LYS1030
C	LYS1030
D	LYS1030
E	LYS1030
F	LYS1030
G	LYS1030
H	LYS1030

site_id	SWS_FT_FI4
Number of Residues	24
Details	MOD_RES: Phosphotyrosine; by autocatalysis => ECO:0000269\|PubMed:11694888, ECO:0000269\|PubMed:18501599, ECO:0000269\|PubMed:19041240

Chain	Residue	Details
A	TYR1158
D	TYR1158
D	TYR1162
D	TYR1163
E	TYR1158
E	TYR1162
E	TYR1163
F	TYR1158
F	TYR1162
F	TYR1163
G	TYR1158
A	TYR1162
G	TYR1162
G	TYR1163
H	TYR1158
H	TYR1162
H	TYR1163
A	TYR1163
B	TYR1158
B	TYR1162
B	TYR1163
C	TYR1158
C	TYR1162
C	TYR1163

site_id	SWS_FT_FI5
Number of Residues	8
Details	MOD_RES: Phosphoserine; by GSK3-beta => ECO:0000250\|UniProtKB:Q60751

Chain	Residue	Details
A	SER1275
B	SER1275
C	SER1275
D	SER1275
E	SER1275
F	SER1275
G	SER1275
H	SER1275

site_id	SWS_FT_FI6
Number of Residues	8
Details	MOD_RES: Phosphoserine => ECO:0000250\|UniProtKB:Q60751

Chain	Residue	Details
A	SER1279
B	SER1279
C	SER1279
D	SER1279
E	SER1279
F	SER1279
G	SER1279
H	SER1279

site_id	SWS_FT_FI7
Number of Residues	24
Details	CROSSLNK: Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in ubiquitin) => ECO:0000269\|PubMed:21994939

Chain	Residue	Details
A	LYS1165
D	LYS1165
D	LYS1168
E	LYS1165
E	LYS1168
F	LYS1165
F	LYS1168
G	LYS1165
G	LYS1168
H	LYS1165
H	LYS1168
A	LYS1168
B	LYS1165
B	LYS1168
C	LYS1165
C	LYS1168

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)