SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3jur'

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.
1HPK_A_ACAA80_1
(PLASMINOGEN)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 6 PRO A 243
ASP A 239
ASN A 237
ASP A 260
 None
 1.48A 1hpkA-3jurA:
undetectable		 1hpkA-3jurA:
10.05
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.
1S3Z_B_RIOB501_0
(AMINOGLYCOSIDE
6'-N-ACETYLTRANSFERA
SE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 8 TYR A 362
GLU A 304
ARG A 324
HIS A 296
 None
 1.24A 1s3zA-3jurA:
undetectable
1s3zB-3jurA:
undetectable		 1s3zA-3jurA:
17.54
1s3zB-3jurA:
17.54
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.
2BNN_B_FCNB1199_1
(EPOXIDASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 8 LEU A 202
GLU A  81
HIS A  83
ALA A 126
 None
 1.03A 2bnnA-3jurA:
undetectable
2bnnB-3jurA:
undetectable		 2bnnA-3jurA:
18.97
2bnnB-3jurA:
18.97
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.
2NNK_A_ROCA401_3
(PROTEASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 12 GLY A 135
ILE A  74
GLY A  72
ILE A  91
VAL A  68
 None
 0.96A 2nnkB-3jurA:
undetectable		 2nnkB-3jurA:
13.33
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.
2XRZ_A_ACTA1467_0
(DEOXYRIBODIPYRIMIDIN
E PHOTOLYASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 5 ARG A 333
ASP A 270
ILE A 108
GLU A 365
 None
 1.46A 2xrzA-3jurA:
undetectable
2xrzB-3jurA:
undetectable		 2xrzA-3jurA:
22.75
2xrzB-3jurA:
22.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BOG_D_DVAD10_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 GLY A 107
GLY A 273
GLY A 268
 None
 0.42A 3bogD-3jurA:
undetectable		 3bogD-3jurA:
10.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EL4_A_ROCA100_2
(PROTEASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 9 ARG A 104
VAL A 193
ILE A 208
GLY A 240
PRO A 218
 None
 1.10A 3el4B-3jurA:
undetectable		 3el4B-3jurA:
12.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G1U_B_ADNB438_1
(ADENOSYLHOMOCYSTEINA
SE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 12 ASP A 134
THR A  87
LEU A  70
GLY A  72
PHE A 192
 None
 1.35A 3g1uB-3jurA:
undetectable		 3g1uB-3jurA:
23.33
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.
3HEG_A_BAXA1_2
(MITOGEN-ACTIVATED
PROTEIN KINASE 14)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 6 VAL A 378
ILE A 358
ILE A 405
LEU A 404
 None
 0.70A 3hegA-3jurA:
undetectable		 3hegA-3jurA:
24.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JW3_A_TOPA208_1
(DIHYDROFOLATE
REDUCTASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 10 ALA A  35
LEU A  62
VAL A  64
ILE A  74
ILE A  88
 None
 1.12A 3jw3A-3jurA:
undetectable		 3jw3A-3jurA:
17.71
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.
3K13_C_THHC643_1
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 ASN A 331
ASP A 363
ARG A 180
 None
 0.88A 3k13C-3jurA:
undetectable		 3k13C-3jurA:
23.29
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.
3LZV_A_017A200_1
(HIV-1 PROTEASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 10 GLY A 135
ILE A  74
GLY A  72
ILE A  91
VAL A  68
 None
 0.97A 3lzvA-3jurA:
undetectable		 3lzvA-3jurA:
12.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C8B_B_0LIB1000_2
(RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 TYR A 440
MET A 426
ILE A 430
 None
 0.91A 4c8bB-3jurA:
undetectable		 4c8bB-3jurA:
21.48
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.
4FUB_A_ACTA311_0
(UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 TYR A 362
ARG A 324
HIS A 296
 None
 0.98A 4fubA-3jurA:
undetectable		 4fubA-3jurA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MMC_A_29JA603_1
(TRANSPORTER)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 10 ASP A 270
TYR A 362
GLY A 107
SER A 306
ASP A 363
 None
 1.46A 4mmcA-3jurA:
undetectable		 4mmcA-3jurA:
21.25
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.
4Q1X_A_017A101_1
(ASPARTYL PROTEASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 11 GLY A 135
ILE A  74
GLY A  72
ILE A  91
VAL A  68
 None
 0.91A 4q1xA-3jurA:
undetectable		 4q1xA-3jurA:
12.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WNW_A_RTZA602_1
(CYTOCHROME P450 2D6)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 12 GLY A 298
LEU A 299
ASP A 242
VAL A 285
VAL A 309
 None
 1.18A 4wnwA-3jurA:
undetectable		 4wnwA-3jurA:
20.46
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.
4XDT_A_ACTA409_0
(FAD:PROTEIN FMN
TRANSFERASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 5 ILE A 251
VAL A 263
ILE A 265
VAL A 285
 None
 0.75A 4xdtA-3jurA:
undetectable		 4xdtA-3jurA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_A_SORA1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 7 LYS A 266
ARG A 269
ARG A 327
ASP A 261
 None
 1.50A 5a06A-3jurA:
undetectable		 5a06A-3jurA:
23.33
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.
5BW4_B_SAMB301_1
(16S RRNA
(ADENINE(1408)-N(1))
-METHYLTRANSFERASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 ASP A 260
GLU A 304
SER A 352
 None
 0.73A 5bw4B-3jurA:
undetectable		 5bw4B-3jurA:
20.35
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.
5D0Y_A_FOLA201_1
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 ARG A 286
LYS A 253
GLU A 252
 None
 0.77A 5d0yA-3jurA:
undetectable		 5d0yA-3jurA:
17.67
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.
5GWX_A_SAMA301_1
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 ARG A 189
ASN A 238
ASP A 261
 None
 0.89A 5gwxA-3jurA:
undetectable		 5gwxA-3jurA:
21.43
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.
5HP1_C_PPFC601_1
(HIV-1 REVERSE
TRANSCRIPTASE P66
SUBUNIT)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 6 ARG A 189
ASP A 260
GLY A 259
ASP A 239
 None
 1.27A 5hp1C-3jurA:
undetectable		 5hp1C-3jurA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LG3_F_Z80F401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 10 ILE A 251
ILE A 241
VAL A 285
ASP A 261
ILE A 265
 None
 1.28A 5lg3F-3jurA:
undetectable		 5lg3F-3jurA:
21.29
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.
5MLM_A_STRA401_1
(-)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 12 MET A 249
ILE A 251
VAL A 264
ILE A 241
PRO A 218
 None
 1.26A 5mlmA-3jurA:
undetectable		 5mlmA-3jurA:
23.20
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.
5N8J_O_DVAO7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 TYR A 113
SER A 114
TRP A 142
 None
 1.04A 5n8jA-3jurA:
undetectable		 5n8jA-3jurA:
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.
5N8J_P_DVAP5_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 TYR A 113
SER A 114
TRP A 142
 None
 1.05A 5n8jD-3jurA:
undetectable		 5n8jD-3jurA:
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.
5TJZ_A_BEZA302_0
(4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		3 / 3 MET A 170
GLU A 178
ARG A 180
 None
 1.08A 5tjzA-3jurA:
undetectable		 5tjzA-3jurA:
19.91
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.
6DEB_B_MTXB303_1
(BIFUNCTIONAL PROTEIN
FOLD)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		4 / 5 TYR A 196
GLN A 194
GLY A 307
ILE A 276
 None
 1.24A 6debB-3jurA:
undetectable		 6debB-3jurA:
11.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F6N_A_SREA508_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 10 VAL A 390
ALA A 389
LEU A 424
LEU A 439
LEU A 404
 None
 1.04A 6f6nA-3jurA:
undetectable
6f6nB-3jurA:
undetectable		 6f6nA-3jurA:
12.24
6f6nB-3jurA:
12.36
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.
6GSD_A_STRA401_0
(PROGESTERONE
5-BETA-REDUCTASE)		 3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE
(Thermotoga
maritima) 		5 / 12 VAL A 203
ILE A 226
SER A 191
TRP A 214
ILE A 241
 None
 1.48A 6gsdA-3jurA:
undetectable		 6gsdA-3jurA:
11.06