SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1dab'

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.
1E7B_A_HLTA4001_1
(SERUM ALBUMIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 5 ARG A 288
ALA A 285
ASP A 265
GLY A 263
 None
 1.02A 1e7bA-1dabA:
undetectable		 1e7bA-1dabA:
20.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E7C_A_HLTA4001_1
(SERUM ALBUMIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 5 ARG A 288
ALA A 285
ASP A 265
GLY A 263
 None
 0.92A 1e7cA-1dabA:
undetectable		 1e7cA-1dabA:
20.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FM6_U_9CRU502_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ALA A 387
ALA A 357
LEU A 383
ALA A 384
ILE A 310
 None
 0.99A 1fm6U-1dabA:
undetectable		 1fm6U-1dabA:
18.57
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.
1HXW_B_RITB301_2
(HIV-1 PROTEASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 ARG A 288
ALA A 339
ASP A 362
VAL A 364
VAL A 344
 None
 0.96A 1hxwB-1dabA:
undetectable		 1hxwB-1dabA:
11.36
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.
1NBI_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A 203
THR A 202
ALA A 206
GLY A 147
HIS A 150
 None
 1.30A 1nbiC-1dabA:
0.0		 1nbiC-1dabA:
20.74
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.
1NBI_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A 203
THR A 202
ALA A 206
GLY A 147
HIS A 150
 None
 1.29A 1nbiD-1dabA:
0.0		 1nbiD-1dabA:
20.74
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.
1RX7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ILE A 201
ALA A 184
ILE A 287
LEU A 273
ILE A 224
 None
 0.93A 1rx7A-1dabA:
undetectable		 1rx7A-1dabA:
15.41
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.
1SG9_C_SAMC303_0
(HEMK PROTEIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 PRO A 346
ILE A 310
GLY A 313
VAL A 266
SER A 267
 None
 1.09A 1sg9C-1dabA:
undetectable		 1sg9C-1dabA:
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.
1VHW_A_ADNA252_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 ARG A  74
GLY A 128
VAL A 129
GLU A 132
ILE A 144
 None
 1.04A 1vhwA-1dabA:
undetectable
1vhwD-1dabA:
undetectable		 1vhwA-1dabA:
17.96
1vhwD-1dabA:
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.
1VHW_C_ADNC252_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 ARG A  74
GLY A 128
VAL A 129
GLU A 132
ILE A 144
 None
 1.07A 1vhwC-1dabA:
undetectable
1vhwE-1dabA:
undetectable		 1vhwC-1dabA:
17.96
1vhwE-1dabA:
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.
1VHW_D_ADND252_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 ARG A  74
GLY A 128
VAL A 129
GLU A 132
ILE A 144
 None
 1.06A 1vhwA-1dabA:
undetectable
1vhwD-1dabA:
undetectable		 1vhwA-1dabA:
17.96
1vhwD-1dabA:
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.
1VHW_E_ADNE252_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 ARG A  74
GLY A 128
VAL A 129
GLU A 132
ILE A 144
 None
 1.04A 1vhwC-1dabA:
undetectable
1vhwE-1dabA:
undetectable		 1vhwC-1dabA:
17.96
1vhwE-1dabA:
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.
2D0K_A_FOLA1161_0
(DIHYDROFOLATE
REDUCTASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ILE A 201
ALA A 184
ILE A 287
LEU A 273
ILE A 224
 None
 0.91A 2d0kA-1dabA:
undetectable		 2d0kA-1dabA:
17.07
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.
2IGT_A_SAMA1001_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ALA A 293
SER A 269
ALA A 211
GLY A 314
GLY A 292
 None
 1.09A 2igtA-1dabA:
undetectable		 2igtA-1dabA:
22.26
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.
2IGT_B_SAMB1002_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ALA A 293
SER A 269
ALA A 211
GLY A 314
GLY A 292
 None
 1.08A 2igtB-1dabA:
undetectable		 2igtB-1dabA:
22.26
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.
2PLW_A_SAMA203_1
(RIBOSOMAL RNA
METHYLTRANSFERASE,
PUTATIVE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		3 / 3 SER A 447
ASP A 402
ASP A 422
 None
 0.60A 2plwA-1dabA:
undetectable		 2plwA-1dabA:
16.23
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.
2ZUJ_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 8 VAL A 186
VAL A 271
LEU A 273
VAL A 217
 None
 0.82A 2zujA-1dabA:
undetectable		 2zujA-1dabA:
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.
3ARU_A_PNXA607_1
(CHITINASE A)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 8 VAL A  61
GLY A  77
THR A  78
GLY A 128
ALA A 106
 None
 1.20A 3aruA-1dabA:
undetectable		 3aruA-1dabA:
23.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DCM_X_SAMX5452_0
(UNCHARACTERIZED
PROTEIN TM_1570)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 GLY A 307
ILE A 287
LEU A 302
SER A 303
ALA A 286
 None
 0.92A 3dcmX-1dabA:
undetectable		 3dcmX-1dabA:
14.68
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.
3ELU_A_SAMA4633_0
(METHYLTRANSFERASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A  11
GLY A  44
THR A  78
PHE A  56
ILE A  35
 None
 1.07A 3eluA-1dabA:
undetectable		 3eluA-1dabA:
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.
3EM6_A_017A200_1
(PROTEASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 8 ALA A 404
ASP A 402
GLY A 448
LEU A 449
VAL A 407
 None
 1.13A 3em6A-1dabA:
0.0		 3em6A-1dabA:
11.74
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.
3FAL_C_REAC501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 10 ALA A 387
ALA A 357
LEU A 383
ALA A 384
ILE A 310
 None
 1.02A 3falC-1dabA:
undetectable		 3falC-1dabA:
18.57
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.
3G2O_B_SAMB600_0
(PCZA361.24)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ALA A 215
GLY A 190
SER A 267
GLY A 268
SER A 269
 None
 1.05A 3g2oB-1dabA:
undetectable		 3g2oB-1dabA:
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.
3G89_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A 203
ASP A 228
ALA A 229
ALA A 231
ALA A 182
 None
 0.99A 3g89A-1dabA:
0.0		 3g89A-1dabA:
19.81
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.
3G89_B_SAMB303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 GLY A 203
ASP A 228
ALA A 229
ALA A 231
ALA A 182
 None
 0.99A 3g89B-1dabA:
0.0		 3g89B-1dabA:
19.81
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.
3G8B_B_SAMB303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A 203
ASP A 228
ALA A 229
ALA A 231
ALA A 182
 None
 1.03A 3g8bB-1dabA:
0.0		 3g8bB-1dabA:
19.81
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.
3IK6_B_HCZB262_1
(GLUTAMATE RECEPTOR 2)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 10 ILE A 401
SER A 421
SER A 447
GLY A 423
LEU A 417
 None
 1.27A 3ik6B-1dabA:
0.0
3ik6E-1dabA:
0.0		 3ik6B-1dabA:
17.26
3ik6E-1dabA:
17.26
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.
3IK6_B_HCZB800_1
(GLUTAMATE RECEPTOR 2)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 10 LEU A 417
ILE A 401
SER A 421
SER A 447
GLY A 423
 None
 1.42A 3ik6B-1dabA:
undetectable
3ik6E-1dabA:
undetectable		 3ik6B-1dabA:
17.26
3ik6E-1dabA:
17.26
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.
3JAY_A_SAMA1102_1
(STRUCTURAL PROTEIN
VP3)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		3 / 3 ARG A 451
ASP A 462
ASP A 426
 None
 0.87A 3jayA-1dabA:
0.0		 3jayA-1dabA:
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.
3QJ7_A_SPMA264_1
(THYMIDYLATE SYNTHASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 8 ALA A 222
LEU A 219
ASP A 197
ASP A 171
 None
 0.91A 3qj7A-1dabA:
0.0
3qj7D-1dabA:
undetectable		 3qj7A-1dabA:
19.29
3qj7D-1dabA:
19.29
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.
3SM2_A_478A126_2
(GAG-PRO-POL
POLYPROTEIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 ALA A 211
VAL A 217
VAL A 186
GLY A 208
LEU A 194
 None
 1.05A 3sm2B-1dabA:
undetectable		 3sm2B-1dabA:
13.72
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.
3SUD_D_SUED1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A 260
GLY A 263
ALA A 207
ALA A 211
SER A 269
 None
 1.04A 3sudD-1dabA:
undetectable		 3sudD-1dabA:
18.18
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.
3UAW_A_ADNA236_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 ARG A  74
GLY A 128
VAL A 129
GLU A 132
ILE A 144
 None
 1.07A 3uawA-1dabA:
undetectable		 3uawA-1dabA:
19.29
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.
3UAY_A_ADNA236_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 10 ARG A  74
GLY A 128
VAL A 129
GLU A 132
ILE A 144
 None
 1.08A 3uayA-1dabA:
undetectable		 3uayA-1dabA:
19.29
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.
4AE1_A_NCAA1536_0
(DIPHTHERIA TOXIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 6 GLY A 337
TYR A 342
ALA A 304
GLU A 311
 None
 0.99A 4ae1A-1dabA:
undetectable		 4ae1A-1dabA:
24.25
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.
4CP3_B_RBTB1129_1
(B-CELL LYMPHOMA 6
PROTEIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 7 ARG A  13
ARG A  40
GLY A  44
SER A  63
 None
 0.95A 4cp3A-1dabA:
0.0
4cp3B-1dabA:
0.0		 4cp3A-1dabA:
11.91
4cp3B-1dabA:
11.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4E1G_A_LNLA701_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 5 ARG A 343
VAL A 381
LEU A 399
SER A 398
 None
 1.29A 4e1gA-1dabA:
undetectable		 4e1gA-1dabA:
20.87
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.
4FN9_A_STRA301_1
(STEROID RECEPTOR 2)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 LEU A 341
LEU A 340
ALA A 339
ALA A 285
THR A 366
 None
 0.93A 4fn9A-1dabA:
undetectable		 4fn9A-1dabA:
18.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G1B_B_ECNB403_1
(FLAVOHEMOGLOBIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 THR A  92
ALA A  94
LEU A  93
THR A  78
VAL A  79
 None
 1.06A 4g1bB-1dabA:
0.0		 4g1bB-1dabA:
21.67
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.
4LL3_A_017A202_2
(PROTEASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 9 ARG A 288
ALA A 339
ASP A 362
VAL A 364
VAL A 344
 None
 1.10A 4ll3B-1dabA:
undetectable		 4ll3B-1dabA:
11.36
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.
4NKV_A_AERA601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 5 TYR A 342
LEU A 325
ASP A 265
VAL A 297
 None
 1.22A 4nkvA-1dabA:
0.0		 4nkvA-1dabA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O33_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A 208
ALA A 184
GLY A 203
GLY A 204
VAL A 174
 None
 0.96A 4o33A-1dabA:
undetectable		 4o33A-1dabA:
20.65
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.
4O3F_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A 125
ALA A 126
GLY A 128
GLY A 127
GLY A 148
 None
 0.91A 4o3fA-1dabA:
undetectable		 4o3fA-1dabA:
21.07
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.
4O3F_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLY A 181
ALA A 182
GLY A 252
GLY A 253
PHE A 254
 None
 0.91A 4o3fA-1dabA:
undetectable		 4o3fA-1dabA:
21.07
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.
4OAE_A_CLMA207_0
(GNAT SUPERFAMILY
ACETYLTRANSFERASE
PA4794)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		6 / 12 PHE A 318
PRO A 346
ALA A 315
ALA A 323
ALA A 293
GLY A 268
 None
 1.30A 4oaeA-1dabA:
undetectable		 4oaeA-1dabA:
14.93
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.
4ODO_B_FK5B203_2
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		3 / 3 ALA A  88
GLN A 124
GLY A 232
 None
 0.59A 4odoC-1dabA:
0.0		 4odoC-1dabA:
14.68
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.
4XP4_A_COCA706_1
(DOPAMINE TRANSPORTER)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 11 ASP A 146
ALA A 231
GLY A 104
SER A 180
GLY A 253
 None
 1.26A 4xp4A-1dabA:
undetectable		 4xp4A-1dabA:
23.67
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.
5I3C_A_AC2A301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 9 ARG A  74
GLY A 128
VAL A 129
GLU A 132
ILE A 144
 None
 1.13A 5i3cA-1dabA:
undetectable		 5i3cA-1dabA:
18.82
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.
5KM8_B_L8PB201_1
(HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN 2,
MITOCHONDRIAL)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 8 GLN A 330
ALA A 387
GLN A 386
SER A 385
 None
 0.88A 5km8A-1dabA:
undetectable
5km8B-1dabA:
undetectable		 5km8A-1dabA:
13.91
5km8B-1dabA:
13.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MWY_A_YNUA1101_0
(MINERALOCORTICOID
RECEPTOR)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 LEU A 329
LEU A 353
ALA A 384
SER A 400
LEU A 399
 None
 1.16A 5mwyA-1dabA:
undetectable		 5mwyA-1dabA:
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.
6A5Y_D_9CRD501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ALA A 387
ALA A 357
LEU A 383
ALA A 384
ILE A 310
 None
 0.92A 6a5yD-1dabA:
undetectable		 6a5yD-1dabA:
10.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6A5Z_D_9CRD501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ALA A 387
ALA A 357
LEU A 383
ALA A 384
ILE A 310
 None
 0.97A 6a5zD-1dabA:
undetectable		 6a5zD-1dabA:
10.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6A5Z_L_9CRL501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 ALA A 387
ALA A 357
LEU A 383
ALA A 384
ILE A 310
 None
 0.97A 6a5zL-1dabA:
undetectable		 6a5zL-1dabA:
10.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BKL_G_EU7G101_0
(MATRIX PROTEIN 2)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 9 ALA A 182
ALA A 126
SER A 180
GLY A 252
GLY A 104
 None
 1.22A 6bklE-1dabA:
undetectable
6bklF-1dabA:
undetectable
6bklG-1dabA:
undetectable
6bklH-1dabA:
undetectable		 6bklE-1dabA:
5.48
6bklF-1dabA:
5.48
6bklG-1dabA:
5.48
6bklH-1dabA:
5.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BQ4_B_ADNB401_1
(THERMOSPERMINE
SYNTHASE ACAULIS
PROTEIN)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 GLN A 130
GLY A 255
ALA A 210
LEU A 189
ALA A 153
 None
 1.10A 6bq4B-1dabA:
undetectable		 6bq4B-1dabA:
8.30
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.
6BRD_B_RFPB502_1
(RIFAMPIN
MONOOXYGENASE)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		5 / 12 HIS A 150
GLY A 243
VAL A 240
GLY A 127
GLY A 147
 None
 1.22A 6brdB-1dabA:
undetectable		 6brdB-1dabA:
10.54
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.
6DWN_B_AQ4B602_1
(CYTOCHROME P450 1A1)		 1dab P.69 PERTACTIN
(Bordetella
pertussis) 		4 / 7 SER A  63
GLY A 125
ALA A 126
VAL A 240
 None
 0.85A 6dwnB-1dabA:
0.0		 6dwnB-1dabA:
9.07