SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1cyg'

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_A_QPSA1001_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		11 / 12 HIS A  94
TYR A  96
LEU A 190
LEU A 193
ASP A 225
ALA A 226
GLU A 253
HIS A 323
ASP A 324
ASP A 367
ARG A 371
 None
 0.55A 1dedA-1cygA:
60.4		 1dedA-1cygA:
63.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_A_QPSA1001_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 TYR A  96
LEU A 193
ASP A 225
HIS A 323
ASP A 367
ARG A 371
 None
 1.36A 1dedA-1cygA:
60.4		 1dedA-1cygA:
63.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_A_QPSA1001_2
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		8 / 9 TYR A  93
TRP A  97
HIS A 136
ASP A 192
ARG A 223
LYS A 228
TRP A 254
PHE A 255
 None
 0.57A 1dedA-1cygA:
60.4		 1dedA-1cygA:
63.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_A_QPSA2001_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 6 TRP A 609
LYS A 644
TRP A 656
GLY A 659
ASN A 661
 None
 0.98A 1dedA-1cygA:
60.4		 1dedA-1cygA:
63.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_B_QPSB1501_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		10 / 12 HIS A  94
TYR A  96
LEU A 193
ARG A 223
ASP A 225
ALA A 226
GLU A 253
HIS A 323
ASP A 324
ARG A 371
 None
 0.52A 1dedB-1cygA:
63.5		 1dedB-1cygA:
63.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_B_QPSB1501_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		8 / 12 HIS A  94
TYR A  96
LEU A 193
ASP A 225
ALA A 226
PHE A 255
HIS A 323
ARG A 371
 None
 0.64A 1dedB-1cygA:
63.5		 1dedB-1cygA:
63.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_B_QPSB1501_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		7 / 12 TYR A  96
LEU A 190
ARG A 223
ASP A 225
HIS A 323
ASP A 324
ARG A 371
 None
 1.31A 1dedB-1cygA:
63.5		 1dedB-1cygA:
63.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_B_QPSB1501_2
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 9 TRP A  97
HIS A 136
PHE A 179
LEU A 190
ASP A 192
LYS A 228
 None
 0.67A 1dedB-1cygA:
63.5		 1dedB-1cygA:
63.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DED_B_QPSB1501_2
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 9 TRP A  97
HIS A 136
PHE A 179
LEU A 190
LYS A 228
ASP A 367
 None
 0.58A 1dedB-1cygA:
63.5		 1dedB-1cygA:
63.43
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.
1LIN_A_TFPA154_1
(CALMODULIN)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 7 MET A 504
GLU A 573
LEU A 575
GLU A 605
 None
 1.06A 1linA-1cygA:
undetectable		 1linA-1cygA:
13.08
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.
1MXD_A_ACRA735_1
(ALPHA AMYLASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		7 / 12 TYR A  96
HIS A 136
ARG A 223
ASP A 225
GLU A 253
HIS A 323
ASP A 324
 None
 0.85A 1mxdA-1cygA:
30.4		 1mxdA-1cygA:
23.36
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.
1N2X_A_SAMA401_1
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 4 HIS A 499
ASP A 311
SER A 308
ASP A 315
 None
 1.39A 1n2xA-1cygA:
0.5		 1n2xA-1cygA:
17.01
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.
1RJD_C_SAMC803_1
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 6 ARG A  44
ASP A 192
ASP A 195
ASN A 135
 None
None
CA  A 681 (-2.5A)
CA  A 681 (-3.2A)
 1.27A 1rjdC-1cygA:
undetectable		 1rjdC-1cygA:
19.46
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.
1T87_B_CAMB2422_0
(CYTOCHROME P450-CAM)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 7 THR A 318
LEU A 345
VAL A 344
ILE A 303
 None
 0.98A 1t87B-1cygA:
0.0		 1t87B-1cygA:
19.59
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.
2G72_A_SAMA2001_1
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 6 TYR A 355
GLY A 364
TYR A 356
ASN A 365
 None
 1.25A 2g72A-1cygA:
undetectable		 2g72A-1cygA:
16.87
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.
2QL8_A_BEZA143_0
(PUTATIVE REDOX
PROTEIN)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 7 ALA A 307
THR A 306
ALA A 309
ARG A 280
 None
 0.99A 2ql8A-1cygA:
0.0
2ql8B-1cygA:
0.0		 2ql8A-1cygA:
11.65
2ql8B-1cygA:
11.65
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.
2RLC_A_GLYA333_0
(CHOLOYLGLYCINE
HYDROLASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		3 / 3 ASN A 200
ASN A 197
ARG A 583
 None
 0.93A 2rlcA-1cygA:
undetectable		 2rlcA-1cygA:
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.
2W98_A_P1ZA1352_1
(PROSTAGLANDIN
REDUCTASE 2)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 7 TYR A  93
TYR A 356
LEU A  43
ASN A  42
 None
 1.46A 2w98A-1cygA:
1.2
2w98B-1cygA:
undetectable		 2w98A-1cygA:
17.88
2w98B-1cygA:
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.
3AIC_A_ACRA5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		7 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
HIS A 323
ASP A 324
 None
 1.09A 3aicA-1cygA:
7.7		 3aicA-1cygA:
22.75
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.
3AIC_B_ACRB5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		7 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
ASN A 265
HIS A 323
 None
 1.48A 3aicB-1cygA:
5.2		 3aicB-1cygA:
22.75
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.
3AIC_B_ACRB5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		7 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
HIS A 323
ASP A 324
 None
 1.06A 3aicB-1cygA:
5.2		 3aicB-1cygA:
22.75
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.
3AIC_C_ACRC5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 ARG A 223
ASP A 225
ALA A 226
GLU A 253
ASP A 324
TYR A  96
 None
 0.91A 3aicC-1cygA:
3.5		 3aicC-1cygA:
22.75
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.
3AIC_C_ACRC5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 ARG A 223
ASP A 225
ALA A 226
HIS A 323
ASP A 324
TYR A  96
 None
 0.91A 3aicC-1cygA:
3.5		 3aicC-1cygA:
22.75
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.
3AIC_D_ACRD5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
ASN A 265
HIS A 323
 None
 1.17A 3aicD-1cygA:
7.5		 3aicD-1cygA:
22.75
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.
3AIC_D_ACRD5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
ASP A 324
 None
 1.03A 3aicD-1cygA:
7.5		 3aicD-1cygA:
22.75
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.
3AIC_D_ACRD5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
HIS A 323
ASP A 324
 None
 0.95A 3aicD-1cygA:
7.5		 3aicD-1cygA:
22.75
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.
3AIC_E_ACRE5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
ASP A 324
 None
 1.01A 3aicE-1cygA:
9.7		 3aicE-1cygA:
22.75
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.
3AIC_E_ACRE5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
HIS A 323
ASP A 324
 None
 0.94A 3aicE-1cygA:
9.7		 3aicE-1cygA:
22.75
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.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
ASN A 265
HIS A 323
 None
 1.17A 3aicF-1cygA:
2.5		 3aicF-1cygA:
22.75
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.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
ASN A 265
 None
 1.49A 3aicF-1cygA:
2.5		 3aicF-1cygA:
22.75
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.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
ASP A 324
 None
 1.00A 3aicF-1cygA:
2.5		 3aicF-1cygA:
22.75
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.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
HIS A 323
ASP A 324
 None
 0.92A 3aicF-1cygA:
2.5		 3aicF-1cygA:
22.75
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.
3AIC_G_ACRG5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
ASN A 265
HIS A 323
 None
 1.18A 3aicG-1cygA:
5.3		 3aicG-1cygA:
22.75
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.
3AIC_G_ACRG5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
ASP A 324
 None
 1.02A 3aicG-1cygA:
5.3		 3aicG-1cygA:
22.75
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.
3AIC_G_ACRG5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		6 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
HIS A 323
ASP A 324
 None
 0.91A 3aicG-1cygA:
5.3		 3aicG-1cygA:
22.75
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.
3AIC_H_ACRH5044_1
(GLUCOSYLTRANSFERASE-
SI)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		7 / 12 LEU A 190
ARG A 223
ASP A 225
ALA A 226
GLU A 253
HIS A 323
ASP A 324
 None
 1.13A 3aicH-1cygA:
5.2		 3aicH-1cygA:
22.75
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.
3ARR_A_PNXA606_1
(CHITINASE A)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 7 GLY A 552
LYS A 553
ASP A 610
TYR A 604
 None
 1.27A 3arrA-1cygA:
9.8		 3arrA-1cygA:
21.88
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.
3ARU_A_PNXA606_1
(CHITINASE A)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 7 GLY A 552
LYS A 553
ASP A 610
TYR A 604
 None
 1.28A 3aruA-1cygA:
9.2		 3aruA-1cygA:
21.88
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.
3PGY_B_GLYB509_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 4 PHE A 101
THR A 137
LEU A 207
TYR A 206
 None
 1.42A 3pgyB-1cygA:
0.6		 3pgyB-1cygA:
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.
3T01_A_PPFA503_1
(PHOSPHONOACETATE
HYDROLASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 7 PHE A   9
THR A  10
ASN A   5
ASP A 315
 None
 1.07A 3t01A-1cygA:
undetectable		 3t01A-1cygA:
22.07
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.
4AFT_D_QMRD301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 8 TYR A  62
TYR A  15
VAL A 338
ILE A 387
 None
 1.11A 4aftD-1cygA:
1.6
4aftE-1cygA:
2.1		 4aftD-1cygA:
15.42
4aftE-1cygA:
15.42
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)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 12 GLY A 481
GLY A 479
VAL A 430
LEU A 460
MET A 340
 None
 1.24A 4f84A-1cygA:
undetectable		 4f84A-1cygA:
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.
4LMN_A_EUIA503_2
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		3 / 3 ASP A  24
VAL A  18
ASN A  29
 CA  A 682 (-3.2A)
None
CA  A 682 (-3.1A)
 0.72A 4lmnA-1cygA:
0.0		 4lmnA-1cygA:
17.65
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.
4MA7_A_P2ZA301_1
(MAJOR PRION PROTEIN)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 8 VAL A 313
LEU A 314
TYR A 402
VAL A 426
 None
 0.97A 4ma7A-1cygA:
undetectable		 4ma7A-1cygA:
10.29
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.
4OLM_A_198A1001_2
(ANDROGEN RECEPTOR)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 6 MET A 230
ILE A 219
ILE A 215
VAL A 248
 None
 0.95A 4olmA-1cygA:
0.0		 4olmA-1cygA:
17.25
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.
4PST_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		3 / 3 ILE A 303
ASP A 278
ARG A 419
 None
 0.62A 4pstA-1cygA:
undetectable		 4pstA-1cygA:
12.69
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.
4QYQ_C_3CJC607_1
(LACTOPEROXIDASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 6 GLN A 316
ASP A 278
ARG A 349
ARG A 280
 None
 1.36A 4qyqC-1cygA:
undetectable		 4qyqC-1cygA:
21.60
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.
4XDT_A_ACTA407_0
(FAD:PROTEIN FMN
TRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		3 / 3 ASP A 461
GLY A 458
ASP A 454
 None
 0.69A 4xdtA-1cygA:
0.0		 4xdtA-1cygA:
16.72
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.
4Y0Q_A_PX9A201_0
(BETA-LACTOGLOBULIN)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A 314
VAL A 313
ILE A 303
VAL A 344
LEU A 285
 None
 0.98A 4y0qA-1cygA:
0.0		 4y0qA-1cygA:
10.85
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.
5G48_A_1FLA1375_1
(DNA POLYMERASE III
SUBUNIT BETA)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 8 LEU A 342
ILE A 354
PRO A 352
LEU A 345
 None
 0.97A 5g48A-1cygA:
undetectable		 5g48A-1cygA:
20.59
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.
5GWX_A_SAMA301_1
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		3 / 3 ARG A 116
ASN A  56
ASP A  24
 None
None
CA  A 682 (-3.2A)
 0.93A 5gwxA-1cygA:
undetectable		 5gwxA-1cygA:
16.79
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.
5HPW_C_3CJC609_1
(LACTOPEROXIDASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 6 GLN A 316
ASP A 278
ARG A 349
ARG A 280
 None
 1.36A 5hpwC-1cygA:
undetectable		 5hpwC-1cygA:
21.60
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_E_FK5E201_1
(FK506-BINDING
PROTEIN 1)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 11 VAL A  19
ILE A  73
TRP A  51
ILE A 222
PHE A 114
 None
 1.24A 5hw8E-1cygA:
undetectable		 5hw8E-1cygA:
10.60
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.
5IGY_A_ERYA403_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 6 ASP A  60
ILE A  54
TYR A  15
TYR A 384
 None
 1.05A 5igyA-1cygA:
0.0		 5igyA-1cygA:
16.74
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.
5JMN_A_FUAA1101_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 5 ILE A  54
ILE A 126
HIS A 122
VAL A 128
 None
 0.85A 5jmnA-1cygA:
0.0		 5jmnA-1cygA:
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.
5M0I_B_ACTB303_0
(SWI5-DEPENDENT HO
EXPRESSION PROTEIN 2)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		4 / 5 VAL A 414
ASN A 437
ASP A 477
LEU A 478
 None
 1.30A 5m0iB-1cygA:
0.0		 5m0iB-1cygA:
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.
5MQT_C_STIC302_1
(DEOXYCYTIDINE KINASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 12 GLU A 149
VAL A  80
PRO A 134
LEU A 196
TYR A 206
 None
 1.36A 5mqtC-1cygA:
undetectable		 5mqtC-1cygA:
18.10
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.
5MUR_E_PFLE406_1
(PROTON-GATED ION
CHANNEL)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 10 ILE A  55
ILE A  58
ILE A  71
ILE A  73
ILE A  17
 None
 1.01A 5murE-1cygA:
0.0		 5murE-1cygA:
8.54
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.
6AG0_A_ACRA610_0
(ALPHA-AMYLASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		7 / 12 TYR A  96
HIS A 136
LEU A 190
ASP A 225
HIS A 229
HIS A 323
ASP A 324
 None
 0.78A 6ag0A-1cygA:
26.9		 6ag0A-1cygA:
10.04
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_0
(ALPHA-AMYLASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A 190
ASP A 225
HIS A 229
HIS A 323
ASP A 324
 None
 0.69A 6ag0C-1cygA:
26.9		 6ag0C-1cygA:
10.04
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_0
(ALPHA-AMYLASE)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A 190
ASP A 225
LYS A 228
HIS A 229
HIS A 323
 None
 0.95A 6ag0C-1cygA:
26.9		 6ag0C-1cygA:
10.04
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.
6H7L_A_Y00A406_0
(BETA-1 ADRENERGIC
RECEPTOR)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 12 VAL A 351
ASP A 514
SER A 536
ASN A   3
ASN A   5
 None
 1.13A 6h7lA-1cygA:
undetectable		 6h7lA-1cygA:
7.81
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.
6H7L_B_Y00B405_0
(BETA-1 ADRENERGIC
RECEPTOR)		 1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE
(Geobacillus
stearothermophil
us) 		5 / 12 VAL A 351
ASP A 514
SER A 536
ASN A   3
ASN A   5
 None
 1.12A 6h7lB-1cygA:
undetectable		 6h7lB-1cygA:
7.81