SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5i51'

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.
1FM6_D_BRLD503_1
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 GLY A 156
CYH A 157
SER A 163
LEU A 241
TYR A 205
 TPP  A 701 (-3.5A)
None
None
None
None
 1.29A 1fm6D-5i51A:
undetectable		 1fm6D-5i51A:
17.97
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.
1GTN_F_TRPF81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 8 GLY A 419
HIS A 416
ALA A 166
ILE A 421
 None
 0.82A 1gtnE-5i51A:
undetectable
1gtnF-5i51A:
undetectable		 1gtnE-5i51A:
7.68
1gtnF-5i51A:
7.68
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.
1HK5_A_T44A1008_1
(SERUM ALBUMIN)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 ASP A 230
ALA A 232
LYS A  44
VAL A  41
VAL A 242
 None
 1.43A 1hk5A-5i51A:
3.8		 1hk5A-5i51A:
21.93
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.
1JNO_A_DVAA6_0
(GRAMICIDIN A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ALA A 420
VAL A 450
TRP A 462
 None
 0.79A 1jnoA-5i51A:
undetectable		 1jnoA-5i51A:
1.75
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.
1JNO_B_DVAB6_0
(GRAMICIDIN A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ALA A 420
VAL A 450
TRP A 462
 None
 0.79A 1jnoB-5i51A:
undetectable		 1jnoB-5i51A:
1.75
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.
1MAG_A_DVAA6_0
(GRAMICIDIN A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ALA A 420
VAL A 450
TRP A 462
 None
 0.90A 1magA-5i51A:
undetectable		 1magA-5i51A:
1.75
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.
1MAG_B_DVAB6_0
(GRAMICIDIN A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ALA A 420
VAL A 450
TRP A 462
 None
 0.90A 1magB-5i51A:
undetectable		 1magB-5i51A:
1.75
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.
1MZ9_D_VDYD1001_4
(CARTILAGE OLIGOMERIC
MATRIX PROTEIN)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 4 THR A 386
LEU A 363
VAL A 362
LEU A 343
 None
 0.88A 1mz9D-5i51A:
undetectable		 1mz9D-5i51A:
5.45
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.
1NG8_A_DVAA6_0
(GRAMICIDIN A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ALA A 420
VAL A 450
TRP A 462
 None
 0.84A 1ng8A-5i51A:
undetectable		 1ng8A-5i51A:
3.71
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.
1NG8_B_DVAB6_0
(GRAMICIDIN A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ALA A 420
VAL A 450
TRP A 462
 None
 0.84A 1ng8B-5i51A:
undetectable		 1ng8B-5i51A:
3.71
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.
1NRU_A_DVAA6_0
(GRAMICIDIN A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ALA A 420
VAL A 450
TRP A 462
 None
 0.87A 1nruA-5i51A:
undetectable		 1nruA-5i51A:
1.75
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.
1NRU_B_DVAB6_0
(GRAMICIDIN A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ALA A 420
VAL A 450
TRP A 462
 None
 0.87A 1nruB-5i51A:
undetectable		 1nruB-5i51A:
1.75
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.
2AOF_C_FRDC305_1
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 5 ASP A 183
GLY A 249
PRO A  36
ALA A  37
 None
 0.84A 2aofA-5i51A:
undetectable		 2aofA-5i51A:
9.82
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.
2AOX_A_THAA400_1
(HISTAMINE
N-METHYLTRANSFERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 8 PHE A 197
TYR A 205
TYR A 208
TRP A 182
 None
 1.30A 2aoxA-5i51A:
2.7		 2aoxA-5i51A:
18.09
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.
2F16_K_BO2K1402_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 ALA A 566
ALA A 569
VAL A 582
GLY A 560
ALA A 558
 None
 1.05A 2f16K-5i51A:
undetectable
2f16L-5i51A:
undetectable		 2f16K-5i51A:
14.29
2f16L-5i51A:
16.26
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.
2F16_Y_BO2Y1403_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 ALA A 566
ALA A 569
VAL A 582
GLY A 560
ALA A 558
 None
 1.05A 2f16Y-5i51A:
undetectable
2f16Z-5i51A:
undetectable		 2f16Y-5i51A:
14.29
2f16Z-5i51A:
16.26
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.
2V0M_C_KLNC1498_1
(CYTOCHROME P450 3A4)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 LEU A 173
LEU A 175
PHE A 394
ILE A 421
ALA A 166
 None
 1.20A 2v0mC-5i51A:
undetectable		 2v0mC-5i51A:
19.73
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.
2VL2_B_BEZB1162_0
(PEROXIREDOXIN-5)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 7 PRO A 476
GLY A 475
LEU A 645
PHE A 646
 None
 0.95A 2vl2B-5i51A:
undetectable		 2vl2B-5i51A:
14.57
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.
2ZBP_A_SAMA300_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 GLY A 123
GLY A 119
ILE A 421
LEU A 178
LEU A 175
 None
 1.00A 2zbpA-5i51A:
2.2		 2zbpA-5i51A:
18.05
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 8 GLY A 249
VAL A 260
LEU A 265
PRO A  28
 None
 1.04A 3bgdB-5i51A:
undetectable		 3bgdB-5i51A:
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.
3CE6_A_ADNA500_2
(ADENOSYLHOMOCYSTEINA
SE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 5 THR A 483
THR A 477
HIS A 478
LEU A 471
 None
 1.31A 3ce6A-5i51A:
undetectable		 3ce6A-5i51A:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CE6_C_ADNC500_2
(ADENOSYLHOMOCYSTEINA
SE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 5 THR A 483
THR A 477
HIS A 478
LEU A 471
 None
 1.36A 3ce6C-5i51A:
undetectable		 3ce6C-5i51A:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DGQ_A_EAAA211_1
(GLUTATHIONE
S-TRANSFERASE P)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 5 ARG A 407
ILE A 373
TYR A 435
THR A 461
 None
 1.41A 3dgqA-5i51A:
undetectable		 3dgqA-5i51A:
15.09
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.
3ELZ_A_CHDA151_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 7 TYR A 411
ILE A 425
GLY A 376
LEU A 169
 None
 0.92A 3elzA-5i51A:
undetectable		 3elzA-5i51A:
11.82
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.
3H52_A_486A3_1
(GLUCOCORTICOID
RECEPTOR)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ASN A 434
GLY A 376
LEU A 173
MET A 422
ILE A 421
 None
 1.25A 3h52A-5i51A:
undetectable		 3h52A-5i51A:
16.76
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.
3H9U_B_ADNB438_1
(ADENOSYLHOMOCYSTEINA
SE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 ASN A  64
LEU A  62
GLY A  65
HIS A  66
PHE A  90
 None
None
None
TPP  A 701 ( 3.5A)
None
 1.24A 3h9uB-5i51A:
undetectable		 3h9uB-5i51A:
20.20
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.
3JB1_A_SAMA1101_0
(STRUCTURAL PROTEIN
VP3)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ILE A 126
GLY A 123
ALA A 170
ILE A 421
ALA A 420
 None
 1.04A 3jb1A-5i51A:
1.6		 3jb1A-5i51A:
21.58
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.
3KW2_A_ADNA300_1
(PROBABLE R-RNA
METHYLTRANSFERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 11 ALA A 657
ILE A 554
LEU A 573
LEU A 570
ALA A 580
 None
 1.06A 3kw2A-5i51A:
undetectable		 3kw2A-5i51A:
16.17
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.
3KW2_B_ADNB300_1
(PROBABLE R-RNA
METHYLTRANSFERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 11 ALA A 657
ILE A 554
LEU A 573
LEU A 570
ALA A 580
 None
 1.10A 3kw2B-5i51A:
undetectable		 3kw2B-5i51A:
16.17
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.
3MG0_K_BO2K1402_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		6 / 11 ALA A 566
ALA A 569
VAL A 582
ALA A 499
GLY A 560
ALA A 558
 None
 1.22A 3mg0K-5i51A:
undetectable
3mg0L-5i51A:
undetectable		 3mg0K-5i51A:
14.29
3mg0L-5i51A:
16.26
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.
3MG0_Y_BO2Y1403_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		6 / 12 ALA A 566
ALA A 569
VAL A 582
ALA A 499
GLY A 560
ALA A 558
 None
 1.16A 3mg0Y-5i51A:
undetectable
3mg0Z-5i51A:
undetectable		 3mg0Y-5i51A:
14.29
3mg0Z-5i51A:
16.26
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.
3OHT_B_1N1B2000_1
(P38A)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 ARG A  59
ILE A 126
MET A 422
ASN A 423
VAL A 111
 None
 1.30A 3ohtA-5i51A:
undetectable
3ohtB-5i51A:
undetectable		 3ohtA-5i51A:
22.08
3ohtB-5i51A:
22.08
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 ALA A 131
LEU A 128
ILE A 425
ALA A 426
VAL A 111
 None
None
None
PEG  A 707 (-4.5A)
None
 1.34A 3r9cA-5i51A:
undetectable		 3r9cA-5i51A:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SPK_A_TPVA100_1
(HIV-1 PROTEASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 11 ALA A 420
ILE A 120
GLY A 123
ILE A 126
THR A 112
 None
 1.08A 3spkA-5i51A:
undetectable		 3spkA-5i51A:
10.02
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.
3SUD_C_SUEC1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 GLY A 533
ASP A 500
ARG A 497
ILE A 556
ALA A 558
 None
 0.99A 3sudC-5i51A:
undetectable		 3sudC-5i51A:
15.61
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.
3TEG_A_DAHA416_1
(PHENYLALANYL-TRNA
SYNTHETASE,
MITOCHONDRIAL)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 SER A  10
GLN A   6
PHE A 250
GLY A  33
ALA A  35
 None
 1.14A 3tegA-5i51A:
undetectable		 3tegA-5i51A:
20.54
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.
3UFG_B_LEUB289_0
(GLYCYL-TRNA
SYNTHETASE ALPHA
SUBUNIT)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 PHE A 428
SER A 147
SER A 145
 None
 1.01A 3ufgB-5i51A:
undetectable		 3ufgB-5i51A:
18.56
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.
3UVV_B_9CRB501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ILE A  12
ALA A  16
LEU A  32
ALA A  69
ILE A 222
 None
 1.10A 3uvvB-5i51A:
undetectable		 3uvvB-5i51A:
16.12
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.
3VRM_A_VD3A502_1
(VITAMIN D(3)
25-HYDROXYLASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 PRO A 239
ILE A 120
LEU A 169
ILE A 421
ALA A 420
 None
 1.05A 3vrmA-5i51A:
undetectable		 3vrmA-5i51A:
18.95
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.
4AN2_A_EUIA1382_2
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 4 ASN A 441
SER A 377
LEU A 380
THR A 483
 None
 1.24A 4an2A-5i51A:
undetectable		 4an2A-5i51A:
18.72
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.
4D7H_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ARG A 497
THR A 617
TRP A 620
 None
 1.22A 4d7hA-5i51A:
undetectable		 4d7hA-5i51A:
20.11
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.
4EMA_A_BRLA601_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 GLY A 156
CYH A 157
SER A 163
LEU A 241
TYR A 205
 TPP  A 701 (-3.5A)
None
None
None
None
 1.23A 4emaA-5i51A:
undetectable		 4emaA-5i51A:
18.46
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.
4QVN_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 9 ALA A 657
THR A 660
ALA A 658
VAL A 582
ALA A 580
 None
 1.08A 4qvnK-5i51A:
undetectable
4qvnL-5i51A:
undetectable		 4qvnK-5i51A:
14.57
4qvnL-5i51A:
16.26
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.
4QVN_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 9 ALA A 657
THR A 660
ALA A 658
VAL A 582
ALA A 580
 None
 1.09A 4qvnY-5i51A:
undetectable
4qvnZ-5i51A:
undetectable		 4qvnY-5i51A:
14.57
4qvnZ-5i51A:
16.26
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.
4RET_A_DGXA1107_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 GLN A 526
LEU A 565
LEU A 356
GLY A 560
ALA A 558
 None
 1.28A 4retA-5i51A:
2.0		 4retA-5i51A:
22.57
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.
4RET_C_DGXC2005_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 GLN A 526
LEU A 565
LEU A 356
GLY A 560
ALA A 558
 None
 1.28A 4retC-5i51A:
undetectable		 4retC-5i51A:
22.57
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.
4UG5_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ARG A 497
THR A 617
TRP A 620
 None
 1.20A 4ug5A-5i51A:
1.2		 4ug5A-5i51A:
20.11
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.
4UGL_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ARG A 497
THR A 617
TRP A 620
 None
 1.15A 4uglA-5i51A:
0.0		 4uglA-5i51A:
20.11
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.
4XJ7_D_ADND303_1
(5'/3'-NUCLEOTIDASE
SURE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 LEU A 531
LEU A 546
GLY A 533
SER A 535
PRO A 586
 None
 1.11A 4xj7C-5i51A:
2.7
4xj7D-5i51A:
undetectable		 4xj7C-5i51A:
17.88
4xj7D-5i51A:
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.
4YB6_A_HISA302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 GLY A 437
VAL A 463
THR A 381
SER A 359
LEU A 363
 None
 1.16A 4yb6A-5i51A:
undetectable
4yb6E-5i51A:
undetectable		 4yb6A-5i51A:
20.24
4yb6E-5i51A:
20.24
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.
4YB6_B_HISB302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 GLY A 437
VAL A 463
THR A 381
SER A 359
LEU A 363
 None
 1.15A 4yb6B-5i51A:
undetectable
4yb6C-5i51A:
undetectable		 4yb6B-5i51A:
20.24
4yb6C-5i51A:
20.24
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.
4YB6_E_HISE302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 10 SER A 359
LEU A 363
GLY A 437
VAL A 463
THR A 381
 None
 1.11A 4yb6D-5i51A:
undetectable
4yb6E-5i51A:
undetectable		 4yb6D-5i51A:
20.24
4yb6E-5i51A:
20.24
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.
5G6C_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 ARG A 497
THR A 617
TRP A 620
 None
 1.21A 5g6cA-5i51A:
undetectable		 5g6cA-5i51A:
20.11
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.
5HFJ_B_SAMB301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ALA A 417
THR A 381
GLY A 437
THR A 465
TYR A 435
 None
 1.25A 5hfjB-5i51A:
undetectable		 5hfjB-5i51A:
15.17
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.
5HFJ_C_SAMC301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ALA A 417
THR A 381
GLY A 437
THR A 465
TYR A 435
 None
 1.26A 5hfjC-5i51A:
undetectable		 5hfjC-5i51A:
15.17
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.
5HFJ_G_SAMG301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ALA A 417
THR A 381
GLY A 437
THR A 465
TYR A 435
 None
 1.23A 5hfjG-5i51A:
undetectable		 5hfjG-5i51A:
15.17
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.
5HFJ_H_SAMH301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ALA A 417
THR A 381
GLY A 437
THR A 465
TYR A 435
 None
 1.29A 5hfjH-5i51A:
undetectable		 5hfjH-5i51A:
15.17
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.
5I75_A_68PA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ILE A 512
ALA A 511
SER A 505
LEU A 521
VAL A 370
 None
 1.23A 5i75A-5i51A:
undetectable		 5i75A-5i51A:
22.21
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.
5JI0_D_BRLD501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 GLY A 156
CYH A 157
SER A 163
LEU A 241
TYR A 205
 TPP  A 701 (-3.5A)
None
None
None
None
 1.22A 5ji0D-5i51A:
undetectable		 5ji0D-5i51A:
17.75
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.
5PHH_A_LDPA414_1
(LYSINE-SPECIFIC
DEMETHYLASE 4D)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 6 GLU A 326
ARG A 329
ALA A 325
LEU A 327
TYR A 137
 None
 1.39A 5phhA-5i51A:
undetectable		 5phhA-5i51A:
20.43
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.
5WZ1_B_SAMB601_0
(NS5
METHYLTRANSFERASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		6 / 12 GLY A 209
GLY A 176
GLY A 171
TRP A 210
ASP A  58
ILE A 179
 None
 1.39A 5wz1B-5i51A:
undetectable		 5wz1B-5i51A:
17.96
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.
5X7P_A_ACRA1431_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		4 / 7 ASP A 183
ASP A 155
GLY A 156
ASN A  64
 None
CA  A 703 ( 3.2A)
TPP  A 701 (-3.5A)
None
 1.09A 5x7pA-5i51A:
undetectable		 5x7pA-5i51A:
21.33
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.
6B58_A_ACTA609_0
(FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		3 / 3 HIS A  66
HIS A 100
ARG A  91
 TPP  A 701 ( 3.5A)
F6R  A 702 (-3.9A)
F6R  A 702 ( 4.8A)
 0.97A 6b58A-5i51A:
undetectable		 6b58A-5i51A:
22.45
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.
6EXI_A_ADNA502_0
(ADENOSYLHOMOCYSTEINA
SE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ASN A  64
LEU A  62
GLY A  65
HIS A  66
PHE A  90
 None
None
None
TPP  A 701 ( 3.5A)
None
 1.26A 6exiA-5i51A:
undetectable		 6exiA-5i51A:
9.33
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.
6EXI_D_ADND502_0
(ADENOSYLHOMOCYSTEINA
SE)		 5i51 TRANSKETOLASE
(Scheffersomyces
stipitis) 		5 / 12 ASN A  64
LEU A  62
GLY A  65
HIS A  66
PHE A  90
 None
None
None
TPP  A 701 ( 3.5A)
None
 1.28A 6exiD-5i51A:
undetectable		 6exiD-5i51A:
9.33