SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4gyi'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_A_THAA1_1
(LIVER
CARBOXYLESTERASE I)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		6 / 11 LEU A   3
GLY A  79
GLY A  80
LEU A  76
LEU A  86
HIS A 185
 None
None
None
None
None
EDO  A 403 (-4.1A)
 1.12A 1mx1A-4gyiA:
undetectable		 1mx1A-4gyiA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_D_THAD4_1
(LIVER
CARBOXYLESTERASE I)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		6 / 12 GLY A  79
GLY A  80
LEU A  76
LEU A  19
LEU A  86
HIS A 185
 None
None
None
None
None
EDO  A 403 (-4.1A)
 1.10A 1mx1D-4gyiA:
undetectable		 1mx1D-4gyiA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_D_THAD4_1
(LIVER
CARBOXYLESTERASE I)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		6 / 12 LEU A   3
GLY A  79
GLY A  80
LEU A  76
LEU A  19
HIS A 185
 None
None
None
None
None
EDO  A 403 (-4.1A)
 1.19A 1mx1D-4gyiA:
undetectable		 1mx1D-4gyiA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_F_THAF6_1
(LIVER
CARBOXYLESTERASE I)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		6 / 12 GLY A  79
GLY A  80
LEU A  76
LEU A  19
LEU A  86
HIS A 185
 None
None
None
None
None
EDO  A 403 (-4.1A)
 1.02A 1mx1F-4gyiA:
undetectable		 1mx1F-4gyiA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YA4_A_CTXA1_1
(CES1 PROTEIN)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 12 GLY A  79
GLY A  80
LEU A  19
LEU A  86
HIS A 185
 None
None
None
None
EDO  A 403 (-4.1A)
 1.02A 1ya4A-4gyiA:
undetectable		 1ya4A-4gyiA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PRG_B_BRLB2_1
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 12 LEU A  86
VAL A  98
MET A   8
LEU A  57
LEU A  76
 None
 1.44A 2prgB-4gyiA:
undetectable		 2prgB-4gyiA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BRF_A_SORA1_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		3 / 3 GLY A 103
ASP A 109
SER A 108
 None
None
ADP  A 401 (-2.4A)
 0.71A 3brfA-4gyiA:
undetectable		 3brfA-4gyiA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3THR_A_C2FA1100_0
(GLYCINE
N-METHYLTRANSFERASE)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		4 / 6 HIS A 185
MET A 152
THR A 148
ARG A  75
 EDO  A 403 (-4.1A)
None
None
None
 1.00A 3thrB-4gyiA:
undetectable		 3thrB-4gyiA:
24.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O8F_B_BRLB501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 12 LEU A  86
VAL A  98
MET A   8
LEU A  57
LEU A  76
 None
 1.48A 4o8fB-4gyiA:
0.7		 4o8fB-4gyiA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UIN_H_QI9H1226_0
(FAB 314.3)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 12 HIS A 185
THR A 186
SER A 183
GLY A  79
GLY A 149
 EDO  A 403 (-4.1A)
None
EDO  A 404 ( 4.7A)
None
None
 1.25A 4uinH-4gyiA:
undetectable
4uinL-4gyiA:
undetectable		 4uinH-4gyiA:
19.90
4uinL-4gyiA:
17.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UIN_H_QI9H1226_0
(FAB 314.3)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 12 HIS A 185
THR A 186
SER A 183
GLY A  80
GLY A 149
 EDO  A 403 (-4.1A)
None
EDO  A 404 ( 4.7A)
None
None
 1.41A 4uinH-4gyiA:
undetectable
4uinL-4gyiA:
undetectable		 4uinH-4gyiA:
19.90
4uinL-4gyiA:
17.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WCX_C_SAMC503_0
(BIOTIN AND THIAMIN
SYNTHESIS ASSOCIATED)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 12 GLY A 105
LEU A 123
ARG A 184
ALA A 159
HIS A 185
 ADP  A 401 ( 4.8A)
None
None
None
EDO  A 403 (-4.1A)
 1.27A 4wcxC-4gyiA:
undetectable		 4wcxC-4gyiA:
23.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HW8_G_FK5G201_2
(FK506-BINDING
PROTEIN 1)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 11 ASP A 229
VAL A 277
ILE A 217
ILE A 235
ILE A 255
 PHD  A 257 ( 4.0A)
None
None
None
None
 1.15A 5hw8G-4gyiA:
undetectable		 5hw8G-4gyiA:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ITZ_B_LOCB502_1
(TUBULIN BETA-2B
CHAIN)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 12 LEU A  76
LEU A  57
ALA A  41
ILE A  37
ILE A  40
 None
 1.06A 5itzB-4gyiA:
undetectable		 5itzB-4gyiA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M0I_B_ACTB303_0
(SWI5-DEPENDENT HO
EXPRESSION PROTEIN 2)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		4 / 5 VAL A  98
THR A   5
ASP A  82
LEU A  86
 None
 1.14A 5m0iB-4gyiA:
undetectable		 5m0iB-4gyiA:
23.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XIW_B_LOCB504_2
(TUBULIN BETA CHAIN)		 4gyi RIO2 KINASE
(Chaetomium
thermophilum) 		5 / 12 LEU A  76
LEU A  57
ALA A  41
ILE A  37
ILE A  40
 None
 0.98A 5xiwB-4gyiA:
undetectable		 5xiwB-4gyiA:
15.86