SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2et6'

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.
1FXV_B_PNNB1001_0
(PENICILLIN ACYLASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 7 SER A 593
PHE A 580
ALA A 244
PHE A 242
None
1.14A 1fxvA-2et6A:
undetectable
1fxvB-2et6A:
undetectable
1fxvA-2et6A:
16.67
1fxvB-2et6A:
21.73
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.
1GMK_D_DVAD6_0
(GRAMICIDIN A)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 4 VAL A 324
TRP A 372
ALA A 371
VAL A 350
None
1.49A 1gmkC-2et6A:
undetectable
1gmkD-2et6A:
undetectable
1gmkC-2et6A:
5.28
1gmkD-2et6A:
5.28
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.
1HMY_A_SAMA328_0
(HAEIII
METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 8 GLU A 538
ILE A 494
THR A 453
LEU A 475
None
0.94A 1hmyA-2et6A:
4.7
1hmyA-2et6A:
19.93
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.
2AZX_A_TRPA602_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 8 LEU A 399
ILE A 449
PHE A 441
ILE A 386
None
0.84A 2azxA-2et6A:
undetectable
2azxA-2et6A:
22.41
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.
2BM9_E_SAME301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
6 / 12 LEU A 334
GLY A 329
ASP A 353
ASP A 377
ASN A 402
ALA A 403
None
1.26A 2bm9E-2et6A:
3.9
2bm9E-2et6A:
15.95
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_ACAA501_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 6 ALA A 496
TYR A 459
ILE A 494
ILE A 458
None
1.27A 2dcfA-2et6A:
undetectable
2dcfA-2et6A:
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.
2EJG_A_ADNA1501_1
(235AA LONG
HYPOTHETICAL
BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 7 ARG A 247
TRP A 552
GLU A 237
ALA A 190
None
1.11A 2ejgA-2et6A:
undetectable
2ejgA-2et6A:
17.24
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.
2JN3_A_JN3A130_2
(FATTY ACID-BINDING
PROTEIN, LIVER)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 7 LEU A 524
ARG A 305
GLU A 273
ARG A 270
None
1.06A 2jn3A-2et6A:
undetectable
2jn3A-2et6A:
10.92
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.
2NMZ_B_ROCB401_3
(PROTEASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 LEU A  26
GLY A  17
ALA A  16
ILE A  12
ALA A  29
None
0.84A 2nmzB-2et6A:
undetectable
2nmzB-2et6A:
10.69
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.
2QX6_B_ML1B233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 6 TRP A 552
GLY A 457
GLY A 476
PHE A 235
None
1.04A 2qx6A-2et6A:
5.2
2qx6B-2et6A:
5.2
2qx6A-2et6A:
17.73
2qx6B-2et6A:
17.73
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.
2VCT_C_ASDC1223_1
(GLUTATHIONE
S-TRANSFERASE A2)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 8 ILE A 450
GLY A 529
LEU A 320
PHE A 342
None
0.93A 2vctC-2et6A:
undetectable
2vctC-2et6A:
17.64
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.
3AX9_A_SALA1341_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 8 LEU A 222
SER A 225
PHE A   6
ALA A  33
None
0.96A 3ax9A-2et6A:
undetectable
3ax9A-2et6A:
19.22
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.
3BF1_B_PAUB248_0
(TYPE III
PANTOTHENATE KINASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 LEU A 475
THR A 539
VAL A 495
THR A 455
ILE A 458
None
1.20A 3bf1A-2et6A:
undetectable
3bf1B-2et6A:
undetectable
3bf1A-2et6A:
17.54
3bf1B-2et6A:
17.54
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.
3DMF_A_SAMA388_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 329
GLY A 331
ASP A 377
VAL A 378
VAL A 425
None
0.93A 3dmfA-2et6A:
6.2
3dmfA-2et6A:
22.05
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.
3E9R_A_ACTA700_0
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 6 GLY A 252
TYR A 277
GLY A 548
ASN A 288
None
1.09A 3e9rA-2et6A:
undetectable
3e9rA-2et6A:
18.65
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.
3ELW_A_SAMA4633_0
(METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A  15
GLY A  17
LEU A  40
ASN A  74
VAL A  75
None
0.89A 3elwA-2et6A:
4.7
3elwA-2et6A:
18.71
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.
3EMB_A_SAMA4633_0
(METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A  15
GLY A  17
LEU A  40
ASN A  74
VAL A  75
None
0.75A 3embA-2et6A:
4.9
3embA-2et6A:
18.71
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.
3JUS_A_ECLA600_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 8 LEU A 154
GLY A 537
THR A 453
ILE A 458
None
0.81A 3jusA-2et6A:
undetectable
3jusA-2et6A:
22.70
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.
3JUS_A_ECNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 8 LEU A 154
GLY A 537
THR A 453
ILE A 458
None
0.81A 3jusA-2et6A:
undetectable
3jusA-2et6A:
22.70
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.
3JUS_B_ECLB600_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 8 LEU A 154
GLY A 537
THR A 453
ILE A 458
None
0.71A 3jusB-2et6A:
undetectable
3jusB-2et6A:
22.70
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.
3LSL_G_PZIG801_0
(GLUTAMATE RECEPTOR 2)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
3 / 3 PRO A 151
SER A 594
ASN A 157
None
0.84A 3lslG-2et6A:
undetectable
3lslG-2et6A:
18.20
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.
3R9V_B_DXCB323_0
(INVASIN IPAD)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 7 ILE A 191
VAL A 221
LEU A 224
SER A 225
None
0.58A 3r9vA-2et6A:
undetectable
3r9vB-2et6A:
undetectable
3r9vA-2et6A:
18.45
3r9vB-2et6A:
18.45
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.
3RUN_A_CCSA165_0
(LYSOZYME)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
3 / 3 ASN A 310
ALA A 309
LYS A 257
None
0.92A 3runA-2et6A:
undetectable
3runA-2et6A:
14.24
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.
3UNA_A_SALA1340_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 9 LEU A 222
SER A 225
PHE A   6
VAL A  94
ALA A  33
None
1.49A 3unaA-2et6A:
0.0
3unaA-2et6A:
18.90
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.
3V3O_C_T1CC401_1
(TETX2 PROTEIN)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 11 ASN A 401
GLY A 429
SER A 434
GLY A 476
MET A 107
None
1.38A 3v3oC-2et6A:
4.0
3v3oC-2et6A:
22.20
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.
3VYW_A_SAMA501_0
(MNMC2)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 548
GLY A 253
ASN A 295
GLU A 273
LEU A 524
None
1.12A 3vywA-2et6A:
4.0
3vywA-2et6A:
19.84
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.
3VYW_A_SAMA501_0
(MNMC2)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
6 / 12 GLY A 548
GLY A 253
LEU A 286
GLU A 273
PHE A 256
LEU A 524
None
1.30A 3vywA-2et6A:
4.0
3vywA-2et6A:
19.84
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.
3WDM_A_ADNA901_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 9 ALA A 465
LEU A 177
LEU A 170
ASN A  97
ILE A 145
None
1.13A 3wdmA-2et6A:
3.2
3wdmA-2et6A:
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.
3WDM_C_ADNC301_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 9 ALA A 465
LEU A 177
LEU A 170
ASN A  97
ILE A 145
None
1.12A 3wdmC-2et6A:
3.2
3wdmC-2et6A:
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.
3WDM_D_ADND301_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 10 ALA A 403
GLY A 429
LEU A 326
ASP A 377
ILE A 385
None
1.13A 3wdmD-2et6A:
2.6
3wdmD-2et6A:
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.
4CTJ_A_SAMA1263_0
(NON-STRUCTURAL
PROTEIN 5)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.86A 4ctjA-2et6A:
2.3
4ctjA-2et6A:
18.02
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.
4CTJ_C_SAMC1263_0
(NON-STRUCTURAL
PROTEIN 5)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.90A 4ctjC-2et6A:
4.2
4ctjC-2et6A:
18.02
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.
4CTK_A_SAMA1263_0
(POLYPROTEIN)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.88A 4ctkA-2et6A:
4.8
4ctkA-2et6A:
18.02
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.
4F84_A_SAMA501_0
(GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A  15
GLY A  17
LEU A  40
ASN A  74
VAL A 121
None
1.10A 4f84A-2et6A:
6.7
4f84A-2et6A:
18.81
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 LEU A 224
GLU A 180
GLY A 233
PHE A 173
ILE A 191
None
1.16A 4hytA-2et6A:
3.9
4hytA-2et6A:
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.
4HYT_C_OBNC2004_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 LEU A 224
GLU A 180
GLY A 233
PHE A 173
ILE A 191
None
1.18A 4hytC-2et6A:
undetectable
4hytC-2et6A:
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.
4OBW_A_SAMA602_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 ALA A 472
GLY A 457
SER A 456
ILE A 474
GLY A 476
None
1.09A 4obwA-2et6A:
5.4
4obwA-2et6A:
19.40
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.
5DZK_X_BEZX801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 1
BEZ-LEU-LEU)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 5 ARG A 554
ILE A 597
GLY A 602
LEU A 598
None
0.85A 5dzki-2et6A:
undetectable
5dzkj-2et6A:
undetectable
5dzkx-2et6A:
undetectable
5dzki-2et6A:
16.14
5dzkj-2et6A:
16.14
5dzkx-2et6A:
1.17
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.
5E9Q_A_SAMA301_0
(GENOME POLYPROTEIN)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.89A 5e9qA-2et6A:
4.6
5e9qA-2et6A:
17.38
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.
5EC8_A_SAMA301_0
(GENOME POLYPROTEIN)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.89A 5ec8A-2et6A:
4.7
5ec8A-2et6A:
18.02
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.
5EHG_A_SAMA301_0
(RNA-DIRECTED RNA
POLYMERASE NS5)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.88A 5ehgA-2et6A:
4.5
5ehgA-2et6A:
18.02
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.
5EHG_C_SAMC4001_0
(RNA-DIRECTED RNA
POLYMERASE NS5)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.91A 5ehgC-2et6A:
4.4
5ehgC-2et6A:
18.02
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.
5EIF_A_SAMA301_0
(GENOME POLYPROTEIN)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.87A 5eifA-2et6A:
undetectable
5eifA-2et6A:
18.02
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.
5EKX_B_SAMB4000_0
(NS5
METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.89A 5ekxB-2et6A:
4.1
5ekxB-2et6A:
18.02
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.
5IKM_A_SAMA311_0
(NS5 METHYL
TRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.90A 5ikmA-2et6A:
undetectable
5ikmA-2et6A:
18.83
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.
5IMS_B_ACTB713_0
(ACETOLACTATE
SYNTHASE CATALYTIC
SUBUNIT,
MITOCHONDRIAL)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
3 / 3 GLY A 460
GLN A 464
LYS A 179
None
0.94A 5imsB-2et6A:
2.7
5imsB-2et6A:
22.54
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.
5JGL_A_SAMA301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
3 / 3 GLY A  17
ASP A  39
ASN A  74
None
0.55A 5jglA-2et6A:
5.7
5jglA-2et6A:
18.78
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.
5K7U_A_SAMA601_1
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
3 / 3 ASP A 279
ASN A 586
GLN A 553
None
0.65A 5k7uA-2et6A:
undetectable
5k7uA-2et6A:
16.36
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.
5KQR_A_SAMA301_0
(METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.88A 5kqrA-2et6A:
4.9
5kqrA-2et6A:
18.23
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.
5KQS_A_SAMA307_0
(GENOME POLYPROTEIN)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.89A 5kqsA-2et6A:
2.3
5kqsA-2et6A:
18.23
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.
5L94_A_TESA502_1
(CYTOCHROME P450)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 8 VAL A 389
ILE A 386
ALA A 437
VAL A 325
VAL A 324
None
1.45A 5l94A-2et6A:
undetectable
5l94A-2et6A:
21.46
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.
5M5B_A_SAMA1001_0
(NS5
METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.91A 5m5bA-2et6A:
2.3
5m5bA-2et6A:
18.77
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.
5NJV_A_SAMA301_0
(NS5)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.90A 5njvA-2et6A:
5.0
5njvA-2et6A:
18.90
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.
5NJV_B_SAMB301_0
(NS5)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.89A 5njvB-2et6A:
4.8
5njvB-2et6A:
18.90
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.
5NJV_C_SAMC301_0
(NS5)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.89A 5njvC-2et6A:
undetectable
5njvC-2et6A:
18.90
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.
5O4Y_D_CCSD14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2
PROGRAMMED CELL
DEATH 1 LIGAND 1)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 PHE A 173
LEU A 171
SER A 468
GLY A 457
GLY A 473
None
1.24A 5o4yD-2et6A:
undetectable
5o4yE-2et6A:
undetectable
5o4yD-2et6A:
1.67
5o4yE-2et6A:
12.63
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.
5V02_R_657R201_0
(CALMODULIN-1
SMALL CONDUCTANCE
CALCIUM-ACTIVATED
POTASSIUM CHANNEL
PROTEIN 2)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 10 ALA A 522
LEU A 525
VAL A 526
GLU A 337
ILE A 327
None
0.82A 5v02B-2et6A:
undetectable
5v02R-2et6A:
undetectable
5v02B-2et6A:
9.95
5v02R-2et6A:
14.39
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.
5VIM_A_SAMA301_0
(METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.88A 5vimA-2et6A:
3.3
5vimA-2et6A:
18.00
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.
5VIM_B_SAMB301_0
(METHYLTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.90A 5vimB-2et6A:
4.8
5vimB-2et6A:
18.00
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.
5WZ2_A_SAMA601_0
(NS5 MTASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.89A 5wz2A-2et6A:
undetectable
5wz2A-2et6A:
18.12
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.
5WZ2_B_SAMB601_0
(NS5 MTASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.87A 5wz2B-2et6A:
undetectable
5wz2B-2et6A:
18.12
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.
5WZ2_C_SAMC601_0
(NS5 MTASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 GLY A 333
GLY A 404
GLY A 329
GLY A 335
ILE A 405
None
0.86A 5wz2C-2et6A:
undetectable
5wz2C-2et6A:
18.12
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.
5X23_A_LSNA504_1
(CYTOCHROME P450 2C9)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 8 ILE A 547
PHE A 262
ASN A 310
PRO A 523
None
1.15A 5x23A-2et6A:
undetectable
5x23A-2et6A:
21.14
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.
5ZMQ_K_PACK1_0
(SERINE PROTEASE NS3
PEPTIDE
PAC-DLY-DLY-DAR)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
3 / 3 ALA A 347
VAL A 389
TYR A 393
None
0.31A 5zmqH-2et6A:
undetectable
5zmqH-2et6A:
15.53
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.
6AG0_C_ACRC608_1
(ALPHA-AMYLASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
3 / 3 TYR A 163
ALA A 169
LEU A 170
None
0.65A 6ag0C-2et6A:
undetectable
6ag0C-2et6A:
10.00
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.
6B54_A_OAQA302_0
(SULFOTRANSFERASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
5 / 12 LEU A 524
VAL A 495
LEU A 399
THR A 430
LEU A 433
None
1.10A 6b54A-2et6A:
1.6
6b54A-2et6A:
15.62
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.
6C2M_D_SUED1202_1
(NS3 PROTEASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 9 VAL A  11
HIS A  93
LEU A  26
VAL A  62
None
0.92A 6c2mD-2et6A:
undetectable
6c2mD-2et6A:
9.80
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.
6N91_A_DCFA401_1
(ADENOSINE DEAMINASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 4 HIS A 122
LEU A  20
TYR A  24
GLY A  15
None
1.42A 6n91A-2et6A:
1.5
6n91A-2et6A:
10.07
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.
6N91_A_DCFA401_1
(ADENOSINE DEAMINASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 4 HIS A 426
LEU A 334
TYR A 338
GLY A 329
None
1.45A 6n91A-2et6A:
1.5
6n91A-2et6A:
10.07
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.
6N91_B_DCFB401_1
(ADENOSINE DEAMINASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 4 HIS A 122
LEU A  20
TYR A  24
GLY A  15
None
1.43A 6n91B-2et6A:
undetectable
6n91B-2et6A:
10.07
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.
6N91_B_DCFB401_1
(ADENOSINE DEAMINASE)
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis)
4 / 4 HIS A 426
LEU A 334
TYR A 338
GLY A 329
None
1.45A 6n91B-2et6A:
undetectable
6n91B-2et6A:
10.07