SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1bdg'

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.
1J8U_A_H4BA429_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 7 VAL A 256
LEU A 214
SER A 216
LEU A 219
 None
 0.64A 1j8uA-1bdgA:
undetectable		 1j8uA-1bdgA:
21.66
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.
1MX1_E_THAE5_2
(LIVER
CARBOXYLESTERASE I)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		3 / 3 PHE A 148
LEU A 138
LEU A 134
 None
 0.68A 1mx1E-1bdgA:
undetectable		 1mx1E-1bdgA:
22.20
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.
1XOQ_B_ROFB501_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		3 / 3 MET A  43
ASN A 235
GLN A 291
 None
GLC  A 501 (-3.8A)
GLC  A 501 ( 4.2A)
 1.03A 1xoqB-1bdgA:
undetectable		 1xoqB-1bdgA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2O01_A_PQNA5001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 8 TRP A 273
PHE A 264
ARG A 274
LEU A 270
 None
 0.94A 2o01A-1bdgA:
undetectable		 2o01A-1bdgA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG3_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 ARG A 321
PHE A  19
LEU A 319
PHE A 320
 None
 1.33A 3ag3C-1bdgA:
2.4
3ag3J-1bdgA:
0.0		 3ag3C-1bdgA:
19.33
3ag3J-1bdgA:
7.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FRQ_A_ERYA195_0
(REPRESSOR PROTEIN
MPHR(A))		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 12 THR A 336
LEU A 443
TYR A 293
VAL A 412
ILE A 390
 None
 1.21A 3frqA-1bdgA:
0.0		 3frqA-1bdgA:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IV6_B_SAMB301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 12 GLY A 227
THR A 213
ILE A 390
ASP A 413
LEU A 228
 None
 1.01A 3iv6B-1bdgA:
undetectable		 3iv6B-1bdgA:
20.22
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.
3IV6_D_SAMD301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 12 GLY A 227
THR A 213
ILE A 390
ASP A 413
LEU A 228
 None
 0.97A 3iv6D-1bdgA:
undetectable		 3iv6D-1bdgA:
20.22
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.
3SFU_B_RBVB601_1
(RNA POLYMERASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 9 THR A 234
ASN A 235
TYR A 293
GLY A 262
LEU A 270
 None
GLC  A 501 (-3.8A)
None
None
None
 1.40A 3sfuB-1bdgA:
undetectable		 3sfuB-1bdgA:
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.
3TGV_B_BEZB1_0
(HEME-BINDING PROTEIN
HUTZ)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 6 GLN A 276
PHE A  29
PRO A  28
LEU A  26
 None
 0.93A 3tgvB-1bdgA:
0.0		 3tgvB-1bdgA:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TGV_D_BEZD1_0
(HEME-BINDING PROTEIN
HUTZ)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 6 GLN A 276
PHE A  29
PRO A  28
LEU A  26
 None
 0.92A 3tgvD-1bdgA:
0.0		 3tgvD-1bdgA:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G5J_A_0WMA1103_1
(EPIDERMAL GROWTH
FACTOR RECEPTOR)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 ASN A 352
ARG A 372
HIS A 354
LEU A 357
 None
 1.22A 4g5jA-1bdgA:
0.0		 4g5jA-1bdgA:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4HB8_A_DXCA75_0
(PPCA)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 8 ILE A 257
LEU A  51
ILE A 397
GLY A  44
 None
 0.83A 4hb8A-1bdgA:
undetectable		 4hb8A-1bdgA:
12.23
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.
4LF7_A_PARA1817_1
(16S RRNA
RIBOSOMAL PROTEIN S9
RIBOSOMAL PROTEIN
S10)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		3 / 3 TYR A 338
ARG A 327
SER A 333
 None
 1.15A 4lf7I-1bdgA:
0.0
4lf7J-1bdgA:
0.0		 4lf7I-1bdgA:
15.81
4lf7J-1bdgA:
11.58
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.
4LF8_A_PARA1817_1
(16S RRNA
RIBOSOMAL PROTEIN S9
RIBOSOMAL PROTEIN
S10)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		3 / 3 TYR A 338
ARG A 327
SER A 333
 None
 1.15A 4lf8I-1bdgA:
0.0
4lf8J-1bdgA:
0.0		 4lf8I-1bdgA:
15.81
4lf8J-1bdgA:
11.58
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.
4QVV_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 8 THR A 210
GLY A 233
GLY A 231
VAL A 230
 GLC  A 501 ( 4.3A)
GLC  A 501 (-3.7A)
SO4  A 502 ( 3.9A)
None
 0.75A 4qvvK-1bdgA:
undetectable
4qvvL-1bdgA:
undetectable		 4qvvK-1bdgA:
19.95
4qvvL-1bdgA:
17.84
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.
4QVV_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 8 THR A 210
GLY A 233
GLY A 231
VAL A 230
 GLC  A 501 ( 4.3A)
GLC  A 501 (-3.7A)
SO4  A 502 ( 3.9A)
None
 0.75A 4qvvY-1bdgA:
undetectable
4qvvZ-1bdgA:
undetectable		 4qvvY-1bdgA:
19.95
4qvvZ-1bdgA:
17.84
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.
4R38_B_RBFB201_2
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 8 THR A 353
GLU A 364
LEU A 361
VAL A 314
LEU A 319
 None
 1.36A 4r38B-1bdgA:
0.0		 4r38B-1bdgA:
14.41
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.
4R3A_A_RBFA402_2
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 8 THR A 232
GLU A 304
ASN A 332
LEU A 286
 SO4  A 502 (-3.6A)
None
None
None
 0.87A 4r3aA-1bdgA:
0.3		 4r3aA-1bdgA:
22.68
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.
4XT7_A_TOPA302_1
(RV2671)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 11 ILE A 229
GLY A 414
ASP A 209
GLU A 294
THR A 210
 GLC  A 501 (-4.1A)
SO4  A 502 ( 3.8A)
GLC  A 501 (-3.0A)
GLC  A 501 (-3.2A)
GLC  A 501 ( 4.3A)
 1.32A 4xt7A-1bdgA:
undetectable		 4xt7A-1bdgA:
23.54
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.
4XT8_A_TMQA302_1
(RV2671)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 12 ILE A 229
GLY A 414
ASP A 209
GLU A 294
THR A 210
 GLC  A 501 (-4.1A)
SO4  A 502 ( 3.8A)
GLC  A 501 (-3.0A)
GLC  A 501 (-3.2A)
GLC  A 501 ( 4.3A)
 1.32A 4xt8A-1bdgA:
undetectable		 4xt8A-1bdgA:
23.54
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.
4Y8W_A_STRA604_1
(CYTOCHROME P450
21-HYDROXYLASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 12 VAL A 226
LEU A 228
ILE A 390
GLY A 387
VAL A 297
 None
 1.08A 4y8wA-1bdgA:
0.1		 4y8wA-1bdgA:
21.61
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.
4YHA_E_MZME303_1
(ALPHA-CARBONIC
ANHYDRASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 12 VAL A 226
VAL A 410
LEU A 394
ALA A 391
PRO A 436
 None
 1.24A 4yhaE-1bdgA:
undetectable		 4yhaE-1bdgA:
18.67
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.
5D4N_C_ACTC201_0
(NITROGEN REGULATORY
PROTEIN P-II)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 VAL A 297
VAL A 230
GLY A 231
PHE A 423
 None
None
SO4  A 502 ( 3.9A)
None
 1.10A 5d4nA-1bdgA:
undetectable
5d4nC-1bdgA:
undetectable		 5d4nA-1bdgA:
11.53
5d4nC-1bdgA:
11.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5I8F_A_ML1A210_1
(PHENOLIC OXIDATIVE
COUPLING PROTEIN)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 12 LEU A 443
VAL A 408
VAL A 236
TYR A 293
GLY A 389
 None
 1.27A 5i8fA-1bdgA:
0.0		 5i8fA-1bdgA:
15.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IY5_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 ARG A 321
PHE A  19
LEU A 319
PHE A 320
 None
 1.23A 5iy5P-1bdgA:
2.5
5iy5W-1bdgA:
0.0		 5iy5P-1bdgA:
19.11
5iy5W-1bdgA:
7.92
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.
5TT3_A_EZLA303_1
(ALPHA-CARBONIC
ANHYDRASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 10 VAL A 226
VAL A 410
LEU A 394
ALA A 391
PRO A 436
 None
 1.28A 5tt3A-1bdgA:
undetectable		 5tt3A-1bdgA:
18.67
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.
5TT3_C_EZLC303_1
(ALPHA-CARBONIC
ANHYDRASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 10 VAL A 226
VAL A 410
LEU A 394
ALA A 391
PRO A 436
 None
 1.26A 5tt3C-1bdgA:
undetectable		 5tt3C-1bdgA:
18.67
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.
5VW5_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 8 GLY A 268
GLY A 265
LEU A 292
ALA A 263
 None
 0.73A 5vw5A-1bdgA:
undetectable		 5vw5A-1bdgA:
22.54
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.
5WAU_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 ARG A 321
PHE A  19
LEU A 319
PHE A 320
 None
 1.33A 5wauC-1bdgA:
2.5
5wauJ-1bdgA:
0.0		 5wauC-1bdgA:
19.33
5wauJ-1bdgA:
7.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WAU_C_CHDC308_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 ARG A 321
PHE A  19
LEU A 319
PHE A 320
 None
 1.34A 5wauc-1bdgA:
2.5
5wauj-1bdgA:
0.0		 5wauc-1bdgA:
19.33
5wauj-1bdgA:
7.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X80_B_SALB203_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 6 GLY A 387
TYR A 384
LEU A 443
VAL A 230
 None
 0.90A 5x80A-1bdgA:
0.0
5x80B-1bdgA:
0.0		 5x80A-1bdgA:
17.08
5x80B-1bdgA:
17.08
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.
5XDX_C_CHDC308_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT VIIA-HEART)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 ARG A 321
PHE A  19
LEU A 319
PHE A 320
 None
 1.25A 5xdxC-1bdgA:
2.4
5xdxJ-1bdgA:
0.0		 5xdxC-1bdgA:
19.11
5xdxJ-1bdgA:
7.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDX_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT VIIA-HEART)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 ARG A 321
PHE A  19
LEU A 319
PHE A 320
 None
 1.23A 5xdxP-1bdgA:
2.4
5xdxW-1bdgA:
0.0		 5xdxP-1bdgA:
19.11
5xdxW-1bdgA:
7.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 4 VAL A 379
LEU A 302
LEU A 305
ASP A 278
 None
 1.38A 5xv7A-1bdgA:
0.0		 5xv7A-1bdgA:
11.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BQG_A_ERMA1201_2
(5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		4 / 5 VAL A 230
THR A 234
LEU A 443
VAL A 408
 None
 0.93A 6bqgA-1bdgA:
undetectable		 6bqgA-1bdgA:
9.72
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.
6BRD_B_RFPB502_1
(RIFAMPIN
MONOOXYGENASE)		 1bdg HEXOKINASE
(Schistosoma
mansoni) 		5 / 12 GLY A 179
VAL A 180
PHE A 154
THR A 172
GLY A 174
 None
None
None
GLC  A 501 (-2.7A)
None
 1.21A 6brdB-1bdgA:
0.0		 6brdB-1bdgA:
10.94