SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1h39'

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.
1CEA_B_ACAB90_1
(PLASMINOGEN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 ARG A 488
ASP A 376
ASP A 377
TYR A 420
 None
R03  A 800 ( 4.1A)
R03  A 800 ( 4.3A)
R03  A 800 ( 4.9A)
 1.39A 1ceaB-1h39A:
0.0		 1ceaB-1h39A:
9.29
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.
1CEB_A_AMHA90_1
(PLASMINOGEN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 ARG A 488
ASP A 376
ASP A 377
TYR A 420
 None
R03  A 800 ( 4.1A)
R03  A 800 ( 4.3A)
R03  A 800 ( 4.9A)
 1.25A 1cebA-1h39A:
undetectable		 1cebA-1h39A:
9.29
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.
1DRE_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 MET A 153
SER A 178
ILE A 179
ARG A 183
LEU A 275
 None
 1.01A 1dreA-1h39A:
undetectable		 1dreA-1h39A:
13.47
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.
1GX9_A_REAA1163_1
(BETA-LACTOGLOBULIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 11 LEU A 177
VAL A 148
ILE A 432
VAL A 440
PHE A 166
 None
None
None
R03  A 800 ( 4.9A)
None
 1.06A 1gx9A-1h39A:
0.0		 1gx9A-1h39A:
13.26
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.
1KXH_A_ACRA598_2
(ALPHA-AMYLASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 TRP A  32
TYR A  31
LEU A 340
 None
 0.79A 1kxhA-1h39A:
undetectable		 1kxhA-1h39A:
19.75
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.
1QCA_A_FUAA221_1
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 CYH A 435
PHE A 166
PHE A 434
LEU A 225
 R03  A 800 ( 4.6A)
None
None
None
 1.11A 1qcaA-1h39A:
undetectable		 1qcaA-1h39A:
14.67
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.
1RH3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 MET A 153
SER A 178
ILE A 179
ARG A 183
LEU A 275
 None
 1.10A 1rh3A-1h39A:
undetectable		 1rh3A-1h39A:
13.47
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.
1TH6_A_OINA401_1
(PHOSPHOLIPASE A2)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 GLY A  84
ASP A 536
TYR A 595
PRO A 594
 None
 1.14A 1th6A-1h39A:
undetectable		 1th6A-1h39A:
10.38
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.
1UYU_A_CAMA1416_0
(CYTOCHROME P450-CAM)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 LEU A 385
VAL A 381
THR A 314
ASP A 342
 None
 0.97A 1uyuA-1h39A:
0.0		 1uyuA-1h39A:
21.53
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.
1UYU_B_CAMB1416_0
(CYTOCHROME P450-CAM)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 LEU A 385
VAL A 381
THR A 314
ASP A 342
 None
 1.03A 1uyuB-1h39A:
0.0		 1uyuB-1h39A:
21.53
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.
1XZX_X_T3X500_2
(THYROID HORMONE
RECEPTOR BETA-1)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 PHE A 456
ARG A 397
ASN A 386
 None
 0.79A 1xzxX-1h39A:
0.0		 1xzxX-1h39A:
16.93
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.
2AOU_A_CQAA403_0
(HISTAMINE
N-METHYLTRANSFERASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 TRP A 558
GLY A 498
ASP A 447
TYR A 495
 None
 0.94A 2aouA-1h39A:
undetectable		 2aouA-1h39A:
18.52
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.
2AOU_B_CQAB401_0
(HISTAMINE
N-METHYLTRANSFERASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 TRP A 558
GLY A 498
ASP A 447
TYR A 495
 None
 0.91A 2aouB-1h39A:
undetectable		 2aouB-1h39A:
18.52
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.
2ARM_A_OINA401_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 GLY A  84
ASP A 536
TYR A 595
PRO A 594
 None
 1.14A 2armA-1h39A:
undetectable		 2armA-1h39A:
10.38
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.
2HW2_A_RFPA1200_2
(RIFAMPIN ADP-RIBOSYL
TRANSFERASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 4 TRP A 133
LEU A 136
VAL A  96
LYS A  99
 None
 1.30A 2hw2A-1h39A:
0.0		 2hw2A-1h39A:
11.73
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.
2JJ8_B_AZZB1211_1
(DEOXYNUCLEOSIDE
KINASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 TYR A 495
PHE A 616
VAL A 615
ALA A 320
MET A 561
 None
 1.31A 2jj8B-1h39A:
undetectable		 2jj8B-1h39A:
15.37
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.
2PO7_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 LEU A 161
PRO A 160
LEU A 428
 None
 0.58A 2po7B-1h39A:
undetectable		 2po7B-1h39A:
17.39
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.
2QMZ_B_LDPB502_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 5 PHE A 404
PHE A 456
TRP A 465
GLY A 409
 None
 1.41A 2qmzA-1h39A:
undetectable
2qmzB-1h39A:
undetectable		 2qmzA-1h39A:
16.29
2qmzB-1h39A:
16.29
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.
2QR2_B_VK3B235_1
(PROTEIN (QUINONE
REDUCTASE TYPE 2))		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 6 PHE A 456
TRP A 465
GLY A 415
GLY A 416
 None
 0.91A 2qr2A-1h39A:
0.0
2qr2B-1h39A:
0.0		 2qr2A-1h39A:
16.29
2qr2B-1h39A:
16.29
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.
2QR2_B_VK3B236_1
(PROTEIN (QUINONE
REDUCTASE TYPE 2))		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 5 TRP A 465
GLY A 415
GLY A 416
PHE A 456
 None
 0.92A 2qr2A-1h39A:
0.0
2qr2B-1h39A:
0.0		 2qr2A-1h39A:
16.29
2qr2B-1h39A:
16.29
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.
2VCV_K_ASDK1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 6 LEU A  22
ALA A 324
LEU A 621
ALA A 620
 None
 0.97A 2vcvK-1h39A:
4.0		 2vcvK-1h39A:
16.38
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.
2Y6R_B_CTCB1385_0
(TETX2 PROTEIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 GLN A 366
GLY A 260
GLY A 600
MET A  42
 None
None
None
R03  A 800 ( 4.9A)
 0.76A 2y6rB-1h39A:
undetectable		 2y6rB-1h39A:
22.36
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.
2ZAX_A_CAMA422_0
(CYTOCHROME P450-CAM)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 LEU A 385
VAL A 381
THR A 314
ASP A 342
 None
 1.01A 2zaxA-1h39A:
undetectable		 2zaxA-1h39A:
21.53
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.
3BGR_A_T27A556_1
(REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H
P51 RT)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 11 LEU A  98
VAL A  47
TYR A  67
TRP A  78
LEU A  69
 None
 1.28A 3bgrA-1h39A:
undetectable
3bgrB-1h39A:
0.0		 3bgrA-1h39A:
21.29
3bgrB-1h39A:
19.09
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.
3CCF_A_BEZA261_0
(CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 GLY A 600
TRP A 312
PHE A 365
TYR A 609
 None
R03  A 800 (-3.9A)
R03  A 800 ( 4.0A)
None
 1.42A 3ccfA-1h39A:
undetectable		 3ccfA-1h39A:
17.03
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)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		6 / 12 GLY A 498
GLY A 490
GLY A 496
THR A 599
LEU A 607
PHE A 365
 None
None
None
None
None
R03  A 800 ( 4.0A)
 1.48A 3elwA-1h39A:
undetectable		 3elwA-1h39A:
17.53
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.
3FWG_B_CAMB420_0
(CAMPHOR
5-MONOOXYGENASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 LEU A 385
VAL A 381
THR A 314
ASP A 342
 None
 1.00A 3fwgB-1h39A:
undetectable		 3fwgB-1h39A:
21.68
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.
3KO0_A_TFPA201_1
(PROTEIN S100-A4)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 9 GLY A 608
PHE A 129
PHE A 605
GLY A 600
PHE A 601
 None
None
R03  A 800 (-3.6A)
None
R03  A 800 (-4.6A)
 1.45A 3ko0A-1h39A:
undetectable
3ko0C-1h39A:
undetectable		 3ko0A-1h39A:
9.28
3ko0C-1h39A:
9.28
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.
3KO0_R_TFPR201_1
(PROTEIN S100-A4)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 10 GLY A 608
PHE A 129
PHE A 605
GLY A 600
PHE A 601
 None
None
R03  A 800 (-3.6A)
None
R03  A 800 (-4.6A)
 1.47A 3ko0R-1h39A:
0.0
3ko0T-1h39A:
undetectable		 3ko0R-1h39A:
9.28
3ko0T-1h39A:
9.28
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.
3MNO_A_DEXA784_1
(GLUCOCORTICOID
RECEPTOR)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 GLY A 590
GLN A 585
VAL A  19
LEU A  23
CYH A  25
 None
 1.22A 3mnoA-1h39A:
undetectable		 3mnoA-1h39A:
16.98
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.
3OLS_A_ESTA600_1
(ESTROGEN RECEPTOR
BETA)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 LEU A 319
LEU A 316
ALA A 317
GLY A 337
LEU A 333
 None
 1.09A 3olsA-1h39A:
undetectable		 3olsA-1h39A:
17.11
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.
3SPK_B_TPVB100_2
(HIV-1 PROTEASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		6 / 12 LEU A 340
ALA A 399
ASP A 398
VAL A 382
GLY A 361
ILE A 345
 None
 1.46A 3spkB-1h39A:
undetectable		 3spkB-1h39A:
11.59
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.
3V3N_B_MIYB2001_1
(TETX2 PROTEIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 GLN A 366
GLY A 260
GLY A 600
MET A  42
 None
None
None
R03  A 800 ( 4.9A)
 0.90A 3v3nB-1h39A:
undetectable		 3v3nB-1h39A:
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.
3V3N_C_MIYC2001_1
(TETX2 PROTEIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 GLN A 366
GLY A 260
GLY A 600
MET A  42
 None
None
None
R03  A 800 ( 4.9A)
 0.90A 3v3nC-1h39A:
undetectable		 3v3nC-1h39A:
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.
3V3O_B_T1CB405_1
(TETX2 PROTEIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 GLN A 366
GLY A 260
GLY A 600
ASN A  39
MET A  42
 None
None
None
None
R03  A 800 ( 4.9A)
 1.11A 3v3oB-1h39A:
0.0		 3v3oB-1h39A:
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.
4BBO_D_ACTD1113_0
(BLR5658 PROTEIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 4 TRP A 591
LEU A 621
LEU A 560
THR A 556
 None
 1.30A 4bboD-1h39A:
undetectable		 4bboD-1h39A:
11.00
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.
4MUB_A_OAQA302_0
(SULFOTRANSFERASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 PRO A 429
HIS A 431
VAL A 440
GLY A 603
ASP A 604
 None
None
R03  A 800 ( 4.9A)
None
None
 1.40A 4mubA-1h39A:
undetectable		 4mubA-1h39A:
17.88
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.
4N6P_A_JMSA713_1
(LACTOTRANSFERRIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 4 HIS A 451
ALA A 450
VAL A 448
GLU A 446
 None
 1.37A 4n6pA-1h39A:
0.0		 4n6pA-1h39A:
20.61
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.
4NJU_A_TPVA500_1
(PROTEASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		6 / 12 LEU A 340
ALA A 399
ASP A 398
VAL A 382
GLY A 361
ILE A 345
 None
 1.48A 4njuA-1h39A:
undetectable		 4njuA-1h39A:
10.79
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.
4NJU_C_TPVC500_1
(PROTEASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		6 / 12 LEU A 340
ALA A 399
ASP A 398
VAL A 382
GLY A 361
ILE A 345
 None
 1.48A 4njuC-1h39A:
undetectable		 4njuC-1h39A:
10.79
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.
4OLB_A_TRPA901_0
(PROTEIN ARGONAUTE-2)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 VAL A 382
ALA A 399
PHE A 363
 None
 0.75A 4olbA-1h39A:
undetectable		 4olbA-1h39A:
20.45
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.
4OQR_A_2UOA502_1
(CYP105AS1)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 9 PRO A 150
ILE A 163
VAL A 174
ALA A 172
ALA A 271
 None
 1.27A 4oqrA-1h39A:
0.0		 4oqrA-1h39A:
23.25
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.
4PXM_A_ESTA2000_1
(ESTROGEN RECEPTOR)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 LEU A 319
LEU A 316
ALA A 317
GLY A 337
LEU A 333
 None
 1.11A 4pxmA-1h39A:
undetectable		 4pxmA-1h39A:
18.76
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.
4QVL_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 11 ALA A 620
GLY A 567
GLY A 566
ALA A 565
SER A 502
 None
 0.94A 4qvlK-1h39A:
undetectable
4qvlL-1h39A:
undetectable		 4qvlK-1h39A:
16.23
4qvlL-1h39A:
17.06
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.
4QVL_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 11 ALA A 620
GLY A 567
GLY A 566
ALA A 565
SER A 502
 None
 0.94A 4qvlY-1h39A:
undetectable
4qvlZ-1h39A:
undetectable		 4qvlY-1h39A:
16.23
4qvlZ-1h39A:
17.06
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.
4QVM_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 10 ALA A 620
GLY A 567
GLY A 566
ALA A 565
SER A 502
 None
 0.93A 4qvmY-1h39A:
undetectable
4qvmZ-1h39A:
undetectable		 4qvmY-1h39A:
16.23
4qvmZ-1h39A:
17.06
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.
4W5N_A_IPHA901_0
(PROTEIN ARGONAUTE-2)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 VAL A 382
ALA A 399
PHE A 363
 None
 0.78A 4w5nA-1h39A:
undetectable		 4w5nA-1h39A:
20.45
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.
4XTA_A_DIFA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 9 ALA A 244
LEU A 275
LEU A 272
ILE A 270
 None
 0.94A 4xtaA-1h39A:
undetectable		 4xtaA-1h39A:
19.21
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.
4Z4I_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 VAL A 382
ALA A 399
PHE A 363
 None
 0.77A 4z4iA-1h39A:
undetectable		 4z4iA-1h39A:
20.34
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.
4ZE1_A_X2NA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 TYR A 609
GLY A 598
GLY A 167
PHE A 365
THR A 599
 None
None
None
R03  A 800 ( 4.0A)
None
 1.28A 4ze1A-1h39A:
0.0		 4ze1A-1h39A:
21.57
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.
5BXN_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 11 ALA A 620
GLY A 567
GLY A 566
ALA A 565
SER A 502
 None
 0.94A 5bxnK-1h39A:
undetectable
5bxnL-1h39A:
undetectable		 5bxnK-1h39A:
16.23
5bxnL-1h39A:
17.06
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.
5BXN_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 11 ALA A 620
GLY A 567
GLY A 566
ALA A 565
SER A 502
 None
 0.95A 5bxnY-1h39A:
undetectable
5bxnZ-1h39A:
undetectable		 5bxnY-1h39A:
16.23
5bxnZ-1h39A:
17.06
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.
5DV4_A_NMYA601_2
(CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 GLU A 446
TRP A 489
ASN A 492
 None
R03  A 800 (-4.7A)
None
 0.70A 5dv4A-1h39A:
undetectable		 5dv4A-1h39A:
22.63
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.
5GQB_A_GCSA602_1
(CHITINASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 TRP A 302
GLU A 291
ASP A  57
 None
 0.70A 5gqbA-1h39A:
undetectable		 5gqbA-1h39A:
22.29
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.
5GQB_A_GCSA605_1
(CHITINASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 TRP A 247
ILE A 152
SER A 178
 None
 1.02A 5gqbA-1h39A:
undetectable		 5gqbA-1h39A:
22.29
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.
5HWA_A_GCSA302_1
(CHITOSANASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 ASP A 447
ASP A 376
GLY A 418
TYR A 474
 None
R03  A 800 ( 4.1A)
None
None
 1.03A 5hwaA-1h39A:
0.0		 5hwaA-1h39A:
17.12
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.
5JS1_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 VAL A 382
ALA A 399
PHE A 363
 None
 0.75A 5js1A-1h39A:
0.0		 5js1A-1h39A:
20.45
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.
5L94_A_TESA502_1
(CYTOCHROME P450)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 8 VAL A 507
ILE A 468
ALA A 471
THR A 449
VAL A 500
 None
 1.42A 5l94A-1h39A:
undetectable		 5l94A-1h39A:
19.24
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.
5O96_C_SAMC501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 7 GLY A 577
GLY A 531
THR A 556
ALA A 559
 None
 0.76A 5o96C-1h39A:
undetectable		 5o96C-1h39A:
17.58
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.
5TL8_A_X2NA502_1
(PROTEIN CYP51)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 ALA A 317
ALA A 550
THR A 584
LEU A 581
MET A 561
 None
 1.23A 5tl8A-1h39A:
undetectable		 5tl8A-1h39A:
21.49
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.
5TZO_B_7V7B201_1
(ENDO-1,4-BETA-XYLANA
SE A)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 LEU A 475
VAL A 500
TRP A 558
ALA A 499
GLY A 498
 None
 1.20A 5tzoB-1h39A:
undetectable		 5tzoB-1h39A:
17.30
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.
5UUN_B_ACTB307_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		3 / 3 LEU A 560
ALA A 559
LEU A 581
 None
 0.37A 5uunB-1h39A:
2.5		 5uunB-1h39A:
18.21
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.
5VLM_B_CVIB301_1
(REGULATORY PROTEIN
TETR)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 GLY A 409
TRP A 465
ARG A 470
ASP A 423
 None
 0.89A 5vlmB-1h39A:
1.2		 5vlmB-1h39A:
15.73
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.
6AYC_A_1YNA502_1
(PROTEIN CYP51)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 ALA A 317
ALA A 550
THR A 584
LEU A 581
MET A 561
 None
 1.29A 6aycA-1h39A:
undetectable		 6aycA-1h39A:
8.72
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.
6CNJ_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 TYR A 267
TRP A 133
THR A 130
LEU A  48
 None
 1.48A 6cnjD-1h39A:
undetectable
6cnjE-1h39A:
2.9		 6cnjD-1h39A:
10.30
6cnjE-1h39A:
7.83
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.
6CP4_A_CAMA422_0
(CYTOCHROME P450CAM)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 LEU A 385
VAL A 381
THR A 314
ASP A 342
 None
 1.00A 6cp4A-1h39A:
0.0		 6cp4A-1h39A:
21.24
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.
6DIL_B_TPVB201_0
(HIV-1 PROTEASE)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		6 / 12 LEU A 340
ALA A 399
ASP A 398
VAL A 382
GLY A 361
ILE A 345
 None
 1.45A 6dilA-1h39A:
undetectable		 6dilA-1h39A:
8.90
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.
6ECX_A_SAMA1301_0
(STIE PROTEIN)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		5 / 12 LEU A 340
GLY A 403
GLY A 362
VAL A 382
LEU A 385
 None
 0.88A 6ecxA-1h39A:
undetectable		 6ecxA-1h39A:
20.36
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.
6MN4_A_AM2A301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 ASP A 436
HIS A 226
ARG A 207
GLU A 124
 None
 0.90A 6mn4A-1h39A:
undetectable		 6mn4A-1h39A:
18.96
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.
6MN4_D_AM2D301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 1h39 SQUALENE--HOPENE
CYCLASE
(Alicyclobacillus
acidocaldarius) 		4 / 8 ASP A 436
HIS A 226
ARG A 207
GLU A 124
 None
 1.09A 6mn4D-1h39A:
undetectable		 6mn4D-1h39A:
18.96