SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3cty'

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.
1BX4_A_ADNA350_1
(PROTEIN (ADENOSINE
KINASE))		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 GLN A 253
LEU A 250
GLY A  28
GLY A  25
ASP A  46
 FAD  A1000 (-3.3A)
None
None
FAD  A1000 (-3.6A)
FAD  A1000 (-2.8A)
 0.90A 1bx4A-3ctyA:
undetectable		 1bx4A-3ctyA:
22.19
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.
1OLT_A_SAMA501_0
(OXYGEN-INDEPENDENT
COPROPORPHYRINOGEN
III OXIDASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 THR A 108
ASP A 110
GLY A  91
ILE A  88
ALA A  32
 None
 1.20A 1oltA-3ctyA:
undetectable		 1oltA-3ctyA:
20.87
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.
2ACL_C_REAC503_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 10 ILE A 297
ALA A 300
PHE A  78
ALA A  27
ILE A  69
 FAD  A1000 (-3.7A)
FAD  A1000 ( 4.0A)
None
FAD  A1000 (-3.4A)
None
 1.16A 2aclC-3ctyA:
undetectable		 2aclC-3ctyA:
18.35
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.
2CPP_A_CAMA422_0
(CYTOCHROME P450-CAM)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		4 / 7 PHE A 256
THR A 254
VAL A 289
VAL A 262
 FAD  A1000 (-3.9A)
None
None
None
 1.03A 2cppA-3ctyA:
undetectable		 2cppA-3ctyA:
22.22
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.
2DCF_A_ACAA502_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 TYR A 207
VAL A 197
ASN A 165
GLY A 162
ILE A 183
 None
 1.40A 2dcfA-3ctyA:
undetectable		 2dcfA-3ctyA:
21.70
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.
2OA1_B_ADNB2005_1
(TRYPTOPHAN
HALOGENASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		4 / 7 GLY A 162
GLY A 163
VAL A 213
LEU A 129
 None
 0.60A 2oa1B-3ctyA:
9.1		 2oa1B-3ctyA:
20.39
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.
2QEU_A_ACTA142_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		4 / 5 GLU A 215
ILE A 216
GLY A 133
LYS A 227
 None
 1.15A 2qeuA-3ctyA:
undetectable
2qeuC-3ctyA:
undetectable		 2qeuA-3ctyA:
19.87
2qeuC-3ctyA:
19.87
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.
2W9S_E_TOPE1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		4 / 8 ILE A  97
LEU A 264
ILE A 120
PHE A 256
 None
None
None
FAD  A1000 (-3.9A)
 0.73A 2w9sE-3ctyA:
undetectable		 2w9sE-3ctyA:
19.00
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.
2YVL_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 THR A 160
ILE A 172
GLY A 164
GLY A 167
VAL A 248
 None
 1.05A 2yvlB-3ctyA:
4.6		 2yvlB-3ctyA:
22.99
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.
3F8W_B_ADNB301_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 HIS A 126
GLY A 287
TYR A 269
GLY A 123
ASN A 293
 None
FAD  A1000 (-3.2A)
None
FAD  A1000 (-3.4A)
None
 1.21A 3f8wB-3ctyA:
undetectable		 3f8wB-3ctyA:
20.66
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.
3F8W_C_ADNC302_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 HIS A 126
GLY A 287
TYR A 269
GLY A 123
ASN A 293
 None
FAD  A1000 (-3.2A)
None
FAD  A1000 (-3.4A)
None
 1.19A 3f8wC-3ctyA:
undetectable		 3f8wC-3ctyA:
20.66
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.
3G88_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 11 GLY A  25
GLY A  23
ALA A  50
ALA A  75
ALA A  31
 FAD  A1000 (-3.6A)
FAD  A1000 (-2.9A)
None
None
None
 0.99A 3g88A-3ctyA:
3.6		 3g88A-3ctyA:
19.81
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.
3G88_B_SAMB303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 11 GLY A  25
GLY A  23
ALA A  50
ALA A  75
ALA A  31
 FAD  A1000 (-3.6A)
FAD  A1000 (-2.9A)
None
None
None
 1.00A 3g88B-3ctyA:
3.6		 3g88B-3ctyA:
19.81
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.
3G89_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 GLY A  25
GLY A  23
ALA A  50
ALA A  75
ALA A  31
 FAD  A1000 (-3.6A)
FAD  A1000 (-2.9A)
None
None
None
 1.00A 3g89A-3ctyA:
undetectable		 3g89A-3ctyA:
19.81
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.
3G89_B_SAMB303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 11 GLY A  25
GLY A  23
ALA A  50
ALA A  75
ALA A  31
 FAD  A1000 (-3.6A)
FAD  A1000 (-2.9A)
None
None
None
 1.01A 3g89B-3ctyA:
undetectable		 3g89B-3ctyA:
19.81
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.
3G8B_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 GLY A  25
GLY A  23
ALA A  50
ALA A  75
ALA A  31
 FAD  A1000 (-3.6A)
FAD  A1000 (-2.9A)
None
None
None
 1.00A 3g8bA-3ctyA:
3.6		 3g8bA-3ctyA:
19.81
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.
3G8B_B_SAMB303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 GLY A  25
GLY A  23
ALA A  50
ALA A  75
ALA A  31
 FAD  A1000 (-3.6A)
FAD  A1000 (-2.9A)
None
None
None
 1.01A 3g8bB-3ctyA:
undetectable		 3g8bB-3ctyA:
19.81
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.
3OXV_B_478B200_2
(HIV-1 PROTEASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 10 ALA A  32
ILE A 119
GLY A 304
VAL A 301
ILE A  44
 None
 1.07A 3oxvB-3ctyA:
undetectable		 3oxvB-3ctyA:
16.67
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.
3OXV_C_478C200_2
(HIV-1 PROTEASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 11 ALA A  32
ILE A 119
GLY A 304
VAL A 301
ILE A  44
 None
 1.08A 3oxvD-3ctyA:
undetectable		 3oxvD-3ctyA:
16.67
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.
4DF3_A_SAMA301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 GLY A  28
ALA A  32
ALA A 308
ASP A 303
ALA A 300
 None
None
None
None
FAD  A1000 ( 4.0A)
 1.33A 4df3A-3ctyA:
4.0		 4df3A-3ctyA:
21.30
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.
4L4A_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		4 / 8 PHE A 256
THR A 254
VAL A 289
VAL A 262
 FAD  A1000 (-3.9A)
None
None
None
 1.00A 4l4aA-3ctyA:
undetectable		 4l4aA-3ctyA:
20.71
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.
4ZJZ_A_BEZA1001_0
(BENZOATE-COENZYME A
LIGASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		4 / 8 ALA A 286
GLY A 304
ALA A  31
GLY A  28
 None
 0.67A 4zjzA-3ctyA:
undetectable		 4zjzA-3ctyA:
21.02
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.
5GWY_E_010E6_0
(N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE
MAIN PROTEASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		4 / 4 THR A 124
LEU A  53
HIS A 126
GLY A  52
 None
FAD  A1000 (-4.1A)
None
FAD  A1000 (-3.3A)
 1.26A 5gwyA-3ctyA:
undetectable		 5gwyA-3ctyA:
23.01
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.
5Y80_A_IREA402_0
(CYCLIN-G-ASSOCIATED
KINASE)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		6 / 11 ALA A  86
ASP A  46
VAL A 283
ILE A 120
THR A 122
ILE A  97
 None
FAD  A1000 (-2.8A)
None
None
FAD  A1000 (-3.9A)
None
 1.16A 5y80A-3ctyA:
undetectable		 5y80A-3ctyA:
16.25
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.
6A93_B_8NUB3001_0
(5-HYDROXYTRYPTAMINE
RECEPTOR 2A,SOLUBLE
CYTOCHROME B562)		 3cty THIOREDOXIN
REDUCTASE
(Thermoplasma
acidophilum) 		5 / 12 SER A 173
TYR A 196
VAL A 244
SER A 143
THR A 142
 None
 1.36A 6a93B-3ctyA:
undetectable		 6a93B-3ctyA:
21.59