SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5j44'

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.
1AV2_C_DVAC6_0
(GRAMICIDIN A)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 ALA A 338
VAL A 336
TRP A 359
 None
 0.89A 1av2C-5j44A:
undetectable
1av2D-5j44A:
undetectable		 1av2C-5j44A:
1.60
1av2D-5j44A:
1.60
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.
1BCU_H_PRLH280_0
(ALPHA-THROMBIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 9 ASP A 461
ALA A 460
SER A 437
GLY A 442
GLY A 463
 None
 1.25A 1bcuH-5j44A:
17.3		 1bcuH-5j44A:
13.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1BX4_A_ADNA350_2
(PROTEIN (ADENOSINE
KINASE))		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 LEU A 859
SER A 811
ASN A 871
 None
 0.82A 1bx4A-5j44A:
undetectable		 1bx4A-5j44A:
15.77
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.
1JG3_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 11 GLN A  71
GLY A 346
GLY A 348
LEU A 115
LEU A 300
 None
 1.09A 1jg3A-5j44A:
undetectable		 1jg3A-5j44A:
11.05
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.
1JG3_B_ADNB550_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 11 GLN A  71
GLY A 346
GLY A 348
LEU A 115
LEU A 300
 None
 1.09A 1jg3B-5j44A:
undetectable		 1jg3B-5j44A:
11.05
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.
1LHV_A_NOGA301_1
(SEX HORMONE-BINDING
GLOBULIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 8 THR A  57
ASP A  64
MET A  85
LEU A 112
 None
 1.09A 1lhvA-5j44A:
undetectable		 1lhvA-5j44A:
10.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NT5_A_DVAA6_0
(GRAMICIDIN A)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 ALA A 338
VAL A 336
TRP A 359
 None
 0.83A 1nt5A-5j44A:
undetectable		 1nt5A-5j44A:
1.61
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.
1NT5_B_DVAB6_0
(GRAMICIDIN A)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 ALA A 338
VAL A 336
TRP A 359
 None
 0.83A 1nt5B-5j44A:
undetectable		 1nt5B-5j44A:
1.61
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.
1RS6_B_MTLB871_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 8 SER A 426
ASN A 450
GLN A 429
ASN A 399
 None
 1.32A 1rs6B-5j44A:
undetectable		 1rs6B-5j44A:
16.57
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.
1UNJ_F_DVAF2_0
(7-AMINO-ACTINOMYCIN
D)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 THR A  54
PRO A  62
THR A  56
 None
 0.86A 1unjF-5j44A:
undetectable		 1unjF-5j44A:
1.87
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.
1USQ_A_CLMA1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 PRO A 197
GLY A 200
PRO A 201
ILE A  31
 None
 0.85A 1usqA-5j44A:
undetectable		 1usqA-5j44A:
9.66
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.
1USQ_D_CLMD1142_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 PRO A 197
GLY A 200
PRO A 201
ILE A  31
 None
 0.85A 1usqD-5j44A:
undetectable		 1usqD-5j44A:
9.66
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.
1W5U_C_DVAC6_0
(GRAMICIDIN D)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 ALA A 338
VAL A 336
TRP A 359
 None
 0.82A 1w5uC-5j44A:
undetectable
1w5uD-5j44A:
undetectable		 1w5uC-5j44A:
1.60
1w5uD-5j44A:
1.60
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.
1XDS_A_SAMA5635_0
(PROTEIN RDMB)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 GLY A 326
GLY A 347
GLY A 346
ASP A 258
SER A 113
 None
 0.75A 1xdsA-5j44A:
undetectable		 1xdsA-5j44A:
17.66
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.
1XDS_A_SAMA5635_0
(PROTEIN RDMB)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 TRP A 272
GLY A 326
GLY A 347
LEU A 306
ASP A 258
 None
 1.08A 1xdsA-5j44A:
undetectable		 1xdsA-5j44A:
17.66
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.
1XDS_B_SAMB9635_0
(PROTEIN RDMB)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 GLY A 147
GLY A 148
GLY A 149
LEU A 231
ASN A 204
 None
 1.11A 1xdsB-5j44A:
undetectable		 1xdsB-5j44A:
17.66
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.
1XDS_B_SAMB9635_0
(PROTEIN RDMB)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 GLY A 326
GLY A 347
GLY A 346
ASP A 258
SER A 113
 None
 0.77A 1xdsB-5j44A:
undetectable		 1xdsB-5j44A:
17.66
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.
2A3C_A_PNXA1435_1
(CHITINASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 TYR A 726
GLY A 763
PHE A 739
SER A 762
 None
EPE  A1101 ( 4.7A)
None
None
 1.33A 2a3cA-5j44A:
undetectable		 2a3cA-5j44A:
19.18
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.
2A3C_B_PNXB2434_1
(CHITINASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 TYR A 726
GLY A 763
PHE A 739
SER A 762
 None
EPE  A1101 ( 4.7A)
None
None
 1.38A 2a3cB-5j44A:
undetectable		 2a3cB-5j44A:
19.18
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.
2BJF_A_DXCA330_0
(CHOLOYLGLYCINE
HYDROLASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 PHE A 216
ALA A 122
ILE A 127
THR A 244
LEU A 249
 None
 1.32A 2bjfA-5j44A:
undetectable		 2bjfA-5j44A:
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.
2C49_A_ADNA1301_1
(SUGAR KINASE MJ0406)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 ALA A 464
ASP A 461
GLY A 463
GLY A 442
ALA A 460
 None
 0.90A 2c49A-5j44A:
undetectable		 2c49A-5j44A:
14.77
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.
2EIK_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 8 LYS A 638
LEU A 637
PHE A 608
LEU A 606
 None
 0.90A 2eikP-5j44A:
undetectable
2eikW-5j44A:
undetectable		 2eikP-5j44A:
13.04
2eikW-5j44A:
5.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIL_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 8 LYS A 638
LEU A 637
PHE A 608
LEU A 606
 None
 0.88A 2eilC-5j44A:
undetectable
2eilJ-5j44A:
undetectable		 2eilC-5j44A:
13.04
2eilJ-5j44A:
5.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIM_W_CHDW1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 LYS A 638
LEU A 637
PHE A 608
LEU A 606
 None
 0.89A 2eimP-5j44A:
undetectable
2eimW-5j44A:
undetectable		 2eimP-5j44A:
13.04
2eimW-5j44A:
5.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JKL_B_CLMB1144_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 PRO A 197
GLY A 200
PRO A 201
ILE A  31
 None
 0.84A 2jklB-5j44A:
undetectable		 2jklB-5j44A:
9.66
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.
2VL2_B_BEZB1162_0
(PEROXIREDOXIN-5)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 THR A 422
PRO A 421
GLY A 394
LEU A 398
 None
 1.01A 2vl2B-5j44A:
undetectable		 2vl2B-5j44A:
10.09
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.
2WA2_B_SAMB1267_0
(NON-STRUCTURAL
PROTEIN 5)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		6 / 12 GLY A 442
GLY A 678
GLY A 680
THR A 679
THR A 618
ILE A 614
 None
 1.48A 2wa2B-5j44A:
undetectable		 2wa2B-5j44A:
14.76
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.
2ZTH_A_SAMA305_1
(CATECHOL
O-METHYLTRANSFERASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 SER A 662
GLU A 708
ASP A 640
 None
 0.86A 2zthA-5j44A:
undetectable		 2zthA-5j44A:
12.26
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.
2ZW9_B_SAMB801_0
(LEUCINE CARBOXYL
METHYLTRANSFERASE 2)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 GLY A 346
GLY A 348
LEU A 115
LEU A 300
ASN A 301
 None
 1.20A 2zw9B-5j44A:
undetectable		 2zw9B-5j44A:
20.56
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.
3A50_C_VD3C2001_1
(VITAMIN D
HYDROXYLASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 11 THR A 191
LEU A 231
ASN A 207
LEU A 178
THR A 244
 None
 1.15A 3a50C-5j44A:
undetectable		 3a50C-5j44A:
17.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A50_E_VD3E2001_1
(VITAMIN D
HYDROXYLASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 THR A 191
LEU A 231
ASN A 207
LEU A 178
THR A 244
 None
 1.12A 3a50E-5j44A:
undetectable		 3a50E-5j44A:
17.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 PHE A 169
GLY A 148
ALA A   1
LEU A 146
 None
 0.92A 3bgdA-5j44A:
undetectable		 3bgdA-5j44A:
12.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BOG_C_DVAC47_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 4 GLY A 326
GLY A 303
GLY A 294
GLY A 324
 None
 0.53A 3bogC-5j44A:
undetectable		 3bogC-5j44A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BOG_D_DVAD47_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 4 GLY A 326
GLY A 303
GLY A 294
GLY A 324
 None
 0.61A 3bogD-5j44A:
undetectable		 3bogD-5j44A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BWY_A_SAMA301_1
(COMT PROTEIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 SER A 662
GLU A 708
ASP A 640
 None
 0.81A 3bwyA-5j44A:
undetectable		 3bwyA-5j44A:
11.66
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.
3EM0_B_CHDB150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 PHE A 454
THR A 467
VAL A 391
LEU A 389
ILE A 416
 None
 1.28A 3em0B-5j44A:
undetectable		 3em0B-5j44A:
9.77
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.
3FI0_L_TRPL1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 9 GLN A 430
VAL A 431
ILE A 416
VAL A 391
VAL A 396
 None
 1.49A 3fi0L-5j44A:
undetectable		 3fi0L-5j44A:
15.30
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.
3FL9_B_TOPB200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 ALA A 760
LEU A 758
LEU A 750
ILE A 715
LEU A 713
 None
 1.08A 3fl9B-5j44A:
undetectable		 3fl9B-5j44A:
9.30
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.
3FL9_G_TOPG200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 ALA A 760
LEU A 758
LEU A 750
ILE A 715
LEU A 713
 None
 1.11A 3fl9G-5j44A:
undetectable		 3fl9G-5j44A:
9.30
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.
3GWX_A_EPAA1_2
(PROTEIN (PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
(PPAR-DELTA)))		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 THR A 619
THR A 620
HIS A 611
HIS A 566
MET A 564
 None
 1.23A 3gwxA-5j44A:
undetectable		 3gwxA-5j44A:
13.68
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.
3GWX_B_EPAB3_2
(PROTEIN (PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
(PPAR-DELTA)))		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 LEU A 283
GLN A 360
VAL A 321
LEU A 328
ILE A 349
 None
 1.07A 3gwxB-5j44A:
undetectable		 3gwxB-5j44A:
13.68
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.
3L8L_C_DVAC6_0
(GRAMICIDIN D)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 ALA A 338
VAL A 336
TRP A 359
 None
 0.68A 3l8lC-5j44A:
undetectable
3l8lD-5j44A:
undetectable		 3l8lC-5j44A:
1.60
3l8lD-5j44A:
1.67
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.
3SP9_A_IL2A901_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 THR A 619
THR A 620
HIS A 611
ILE A 614
HIS A 566
 None
 1.25A 3sp9A-5j44A:
undetectable		 3sp9A-5j44A:
13.46
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.
3SP9_B_IL2B901_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 THR A 619
THR A 620
HIS A 611
ILE A 614
HIS A 566
 None
 1.23A 3sp9B-5j44A:
undetectable		 3sp9B-5j44A:
13.46
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.
3WRH_E_CAME503_0
(CAMPHOR
5-MONOOXYGENASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 PHE A 745
LEU A 758
VAL A 732
VAL A 705
 None
 1.14A 3wrhE-5j44A:
undetectable		 3wrhE-5j44A:
16.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZTV_A_ADNA1600_1
(NAD NUCLEOTIDASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 9 GLY A 442
ASN A  92
GLY A 463
TYR A  89
ASP A 461
 None
 1.16A 3ztvA-5j44A:
undetectable		 3ztvA-5j44A:
20.98
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.
4ACB_C_DXCC1477_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 THR A  56
GLY A  63
ARG A  13
LEU A  60
 None
 0.93A 4acbC-5j44A:
undetectable		 4acbC-5j44A:
19.10
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.
4C5N_A_PXLA300_1
(PHOSPHOMETHYLPYRIMID
INE KINASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 GLY A 294
GLY A 279
VAL A 321
MET A 292
 None
 0.83A 4c5nA-5j44A:
undetectable		 4c5nA-5j44A:
14.43
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.
4C5N_C_PXLC300_1
(PHOSPHOMETHYLPYRIMID
INE KINASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 8 GLY A 294
GLY A 279
VAL A 321
MET A 292
 None
 0.78A 4c5nC-5j44A:
undetectable		 4c5nC-5j44A:
14.43
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.
4EJJ_B_NCTB501_1
(CYTOCHROME P450 2A6)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 VAL A  39
GLY A 200
THR A 174
PHE A  12
 None
 0.99A 4ejjB-5j44A:
undetectable		 4ejjB-5j44A:
19.76
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.
4EYS_A_ACTA402_0
(MCCC FAMILY PROTEIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 ASP A 219
SER A 125
ASP A 126
GLU A 123
 None
 0.92A 4eysA-5j44A:
undetectable		 4eysA-5j44A:
14.73
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.
4G3R_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 PHE A 745
LEU A 758
VAL A 732
VAL A 705
 None
 1.12A 4g3rA-5j44A:
undetectable		 4g3rA-5j44A:
16.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G3R_B_CAMB502_0
(CAMPHOR
5-MONOOXYGENASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 PHE A 745
LEU A 758
VAL A 732
VAL A 705
 None
 1.16A 4g3rB-5j44A:
undetectable		 4g3rB-5j44A:
16.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IV0_A_SAMA302_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 VAL A 870
GLY A 861
GLY A 881
ILE A 863
LEU A 833
 None
 1.05A 4iv0A-5j44A:
undetectable		 4iv0A-5j44A:
13.61
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.
4L49_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 5 PHE A 745
LEU A 758
VAL A 732
VAL A 705
 None
 1.17A 4l49A-5j44A:
undetectable		 4l49A-5j44A:
16.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L4C_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 PHE A 745
LEU A 758
VAL A 732
VAL A 705
 None
 1.11A 4l4cA-5j44A:
undetectable		 4l4cA-5j44A:
16.24
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.
4L8F_B_MTXB301_1
(GAMMA-GLUTAMYL
HYDROLASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 11 GLY A 439
GLY A 442
GLY A 443
ALA A 460
GLN A 568
 None
 1.02A 4l8fB-5j44A:
undetectable		 4l8fB-5j44A:
14.77
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.
4OLT_B_GCSB304_1
(CHITOSANASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 5 ILE A 614
THR A 620
HIS A 566
TYR A  89
 None
 1.13A 4oltB-5j44A:
undetectable		 4oltB-5j44A:
15.05
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.
4Q15_A_HFGA803_1
(PROLINE--TRNA LIGASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 GLU A 687
THR A 643
HIS A 645
 None
 0.63A 4q15A-5j44A:
undetectable		 4q15A-5j44A:
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.
4Q15_B_HFGB803_1
(PROLINE--TRNA LIGASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 GLU A 687
THR A 643
HIS A 645
 None
 0.62A 4q15B-5j44A:
undetectable		 4q15B-5j44A:
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.
4QGI_A_ROCA101_1
(PROTEASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 11 GLY A 172
ALA A  16
ILE A  55
THR A  54
GLY A  63
 None
 0.90A 4qgiA-5j44A:
undetectable		 4qgiA-5j44A:
6.04
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.
4QWP_A_GCSA303_1
(CHITOSANASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 ILE A 614
THR A 620
HIS A 566
TYR A  89
 None
 1.16A 4qwpA-5j44A:
undetectable		 4qwpA-5j44A:
15.05
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.
4R29_D_SAMD301_0
(UNCHARACTERIZED
PROTEIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 ALA A   1
ARG A 145
GLY A 172
ILE A  55
GLY A  63
 None
 1.12A 4r29D-5j44A:
undetectable		 4r29D-5j44A:
13.28
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.
4YDQ_B_HFGB802_1
(PROLINE--TRNA LIGASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 GLU A 687
THR A 643
HIS A 645
 None
 0.55A 4ydqB-5j44A:
undetectable		 4ydqB-5j44A:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YHA_B_MZMB303_1
(ALPHA-CARBONIC
ANHYDRASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 10 ASP A  33
VAL A  39
LEU A 202
THR A 174
ALA A 203
 None
 1.39A 4yhaB-5j44A:
undetectable		 4yhaB-5j44A:
12.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AXD_A_RBVA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 THR A 372
HIS A  65
LEU A 112
 None
 0.73A 5axdA-5j44A:
undetectable		 5axdA-5j44A:
18.61
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.
5CDN_N_EVPN2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 6 SER A 180
ASP A 219
ARG A 139
GLY A 138
 None
 0.91A 5cdnR-5j44A:
undetectable
5cdnS-5j44A:
undetectable		 5cdnR-5j44A:
18.71
5cdnS-5j44A:
11.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DZK_W_BEZW801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 1
ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 5 PHE A  12
ILE A  31
GLY A 173
ILE A   7
 None
 0.83A 5dzkB-5j44A:
undetectable
5dzkI-5j44A:
undetectable
5dzkW-5j44A:
undetectable		 5dzkB-5j44A:
11.52
5dzkI-5j44A:
11.05
5dzkW-5j44A:
0.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5E26_C_PAUC602_0
(PANTOTHENATE KINASE
2, MITOCHONDRIAL)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 GLY A 209
SER A 213
ARG A 145
GLY A 147
 None
 0.89A 5e26C-5j44A:
undetectable
5e26D-5j44A:
undetectable		 5e26C-5j44A:
15.88
5e26D-5j44A:
15.88
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.
5JNC_D_ACTD305_0
(CARBONIC ANHYDRASE 4)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 5 PRO A 985
ALA A 973
ILE A 987
LEU A 959
 None
 0.79A 5jncD-5j44A:
undetectable		 5jncD-5j44A:
13.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KPR_A_PAUA404_0
(PANTOTHENATE KINASE
3)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 5 GLY A 209
SER A 213
ARG A 145
GLY A 147
 None
 0.89A 5kprA-5j44A:
undetectable		 5kprA-5j44A:
16.73
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.
5L8D_B_ACTB601_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 THR A 620
PRO A 612
ASP A 589
 None
 0.93A 5l8dB-5j44A:
undetectable		 5l8dB-5j44A:
20.93
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.
5MWU_B_ACTB601_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 THR A 620
PRO A 612
ASP A 589
 None
 0.93A 5mwuB-5j44A:
undetectable		 5mwuB-5j44A:
20.93
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.
5N0X_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 ILE A 349
GLY A 348
HIS A 370
PHE A 411
VAL A 361
 None
 1.25A 5n0xB-5j44A:
undetectable		 5n0xB-5j44A:
16.47
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.
5N8J_E_DVAE7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 TYR A 508
SER A 496
TRP A 537
 None
 0.94A 5n8jB-5j44A:
undetectable		 5n8jB-5j44A:
11.05
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.
5N8J_O_DVAO7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 TYR A 508
SER A 496
TRP A 537
 None
 0.94A 5n8jA-5j44A:
undetectable		 5n8jA-5j44A:
11.05
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.
5N8J_P_DVAP5_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 TYR A 508
SER A 496
TRP A 537
 None
 0.93A 5n8jD-5j44A:
undetectable		 5n8jD-5j44A:
11.05
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.
5TZO_B_7V7B201_1
(ENDO-1,4-BETA-XYLANA
SE A)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 LEU A 666
SER A 711
VAL A 664
ALA A 642
TYR A 701
 None
 1.13A 5tzoB-5j44A:
undetectable		 5tzoB-5j44A:
13.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V1T_A_SAMA605_0
(RADICAL SAM)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 LEU A 818
THR A 799
VAL A 772
SER A 777
THR A 830
 None
 1.27A 5v1tA-5j44A:
undetectable		 5v1tA-5j44A:
18.11
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.
5VKQ_A_PCFA1805_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 VAL A  74
ILE A 228
SER A  52
THR A  66
 None
 0.86A 5vkqA-5j44A:
undetectable
5vkqD-5j44A:
undetectable		 5vkqA-5j44A:
20.98
5vkqD-5j44A:
20.98
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.
5VKQ_B_PCFB1802_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 SER A  52
THR A  66
VAL A  74
ILE A 228
 None
 0.87A 5vkqA-5j44A:
undetectable
5vkqB-5j44A:
undetectable		 5vkqA-5j44A:
20.98
5vkqB-5j44A:
20.98
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.
5VKQ_C_PCFC1803_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 8 SER A  52
THR A  66
VAL A  74
ILE A 228
 None
 0.82A 5vkqB-5j44A:
undetectable
5vkqC-5j44A:
undetectable		 5vkqB-5j44A:
20.98
5vkqC-5j44A:
20.98
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.
5VKQ_D_PCFD1803_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 SER A  52
THR A  66
VAL A  74
ILE A 228
 None
 0.85A 5vkqC-5j44A:
undetectable
5vkqD-5j44A:
undetectable		 5vkqC-5j44A:
20.98
5vkqD-5j44A:
20.98
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.
5X1B_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 5 TYR A 701
MET A 652
THR A 633
LEU A 634
 None
 1.48A 5x1bJ-5j44A:
undetectable		 5x1bJ-5j44A:
5.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6A7P_A_9SCA601_0
(SERUM ALBUMIN)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 ILE A 349
PHE A 257
LEU A 249
GLY A 326
LEU A 115
 None
 1.26A 6a7pA-5j44A:
undetectable		 6a7pA-5j44A:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DGX_A_017A101_1
(PROTEASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 LEU A 666
VAL A 732
GLY A 743
LEU A 752
ILE A 715
 None
 0.93A 6dgxB-5j44A:
undetectable		 6dgxB-5j44A:
6.21
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.
6GNA_A_ACTA307_0
(THIOREDOXIN
REDUCTASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 ARG A 139
LYS A 223
TYR A 218
 None
 1.31A 6gnaA-5j44A:
undetectable		 6gnaA-5j44A:
14.60
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.
6GNB_A_ACTA307_0
(THIOREDOXIN
REDUCTASE)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		3 / 3 ARG A 139
LYS A 223
TYR A 218
 None
 1.31A 6gnbA-5j44A:
undetectable		 6gnbA-5j44A:
14.60
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.
6NJ9_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		5 / 12 GLY A 168
ASP A  64
GLY A  63
GLY A 148
ALA A  16
 None
 0.87A 6nj9K-5j44A:
undetectable		 6nj9K-5j44A:
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.
6NM4_A_SAMA402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
PRDM9)		 5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER
(Shigella
flexneri) 		4 / 7 ALA A 464
GLY A 463
GLY A 680
TYR A  89
 None
 0.68A 6nm4A-5j44A:
undetectable		 6nm4A-5j44A:
10.68