SIMILAR PATTERNS OF AMINO ACIDS FOR 3JB2_A_SAMA1102

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1bhy P64K

(Neisseria
meningitidis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ILE A 549
GLY A 546
GLY A 545
ALA A 478
VAL A 477
 None
 0.94A 3jb2A-1bhyA:
0.0		 3jb2A-1bhyA:
18.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cqj SUCCINYL-COA
SYNTHETASE ALPHA
CHAIN

(Escherichia
coli) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 ILE A 177
GLY A 178
GLY A 179
ALA A 247
PRO A 124
 None
None
None
None
COA  A 901 (-4.1A)
 1.00A 3jb2A-1cqjA:
0.0		 3jb2A-1cqjA:
14.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ek6 UDP-GALACTOSE
4-EPIMERASE

(Homo sapiens) 		PF16363
(GDP_Man_Dehyd) 		5 ILE A  14
GLY A  15
GLY A  12
ALA A  38
ALA A  89
 NAI  A 400 (-3.9A)
None
NAI  A 400 (-3.3A)
NAI  A 400 (-3.4A)
NAI  A 400 (-3.7A)
 0.92A 3jb2A-1ek6A:
4.5		 3jb2A-1ek6A:
15.36
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.
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 164
GLY A 344
ALA A 348
ALA A 401
ALA A 185
 None
 1.00A 3jb2A-1j3nA:
0.0		 3jb2A-1j3nA:
17.60
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		5 TYR B 270
GLY B  72
GLY B  71
ALA B 301
ALA B 109
 None
 0.92A 3jb2A-1jtdB:
0.0		 3jb2A-1jtdB:
13.05
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.
1k4q GLUTATHIONE
REDUCTASE

(Homo sapiens) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 TYR A 391
ILE A 433
GLY A 381
PRO A 368
VAL A 451
 None
 0.87A 3jb2A-1k4qA:
3.3		 3jb2A-1k4qA:
18.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m22 PEPTIDE AMIDASE

(Stenotrophomonas
maltophilia) 		PF01425
(Amidase) 		5 ILE A 313
GLY A 314
ALA A 441
ALA A 452
VAL A 451
 None
 0.92A 3jb2A-1m22A:
0.0		 3jb2A-1m22A:
18.89
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.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 ILE A1253
GLY A1087
ALA A1019
ALA A1050
VAL A1049
 None
 0.83A 3jb2A-1n5xA:
0.0		 3jb2A-1n5xA:
21.47
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.
1pl8 HUMAN SORBITOL
DEHYDROGENASE

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ILE A 161
GLY A 160
PRO A 156
ALA A 191
VAL A 190
 None
 0.75A 3jb2A-1pl8A:
3.4		 3jb2A-1pl8A:
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.
1qo8 FLAVOCYTOCHROME C3
FUMARATE REDUCTASE

(Shewanella
frigidimarina) 		PF00890
(FAD_binding_2)
PF14537
(Cytochrom_c3_2) 		5 ILE A 253
GLY A 157
GLY A 158
ALA A 153
ALA A 132
 None
FAD  A 605 (-4.5A)
FAD  A 605 (-3.3A)
FAD  A 605 ( 3.8A)
FAD  A 605 (-3.3A)
 0.99A 3jb2A-1qo8A:
2.0		 3jb2A-1qo8A:
20.36
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.
1t8w AMP NUCLEOSIDASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1)
PF10423
(AMNp_N) 		5 GLY A 236
GLY A 235
ALA A 254
PRO A 193
ALA A 249
 None
 0.92A 3jb2A-1t8wA:
undetectable		 3jb2A-1t8wA:
19.57
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.
1yix DEOXYRIBONUCLEASE
YCFH

(Escherichia
coli) 		PF01026
(TatD_DNase) 		5 ILE A 128
GLY A  93
ALA A  84
ALA A  41
PRO A  68
 None
 0.88A 3jb2A-1yixA:
undetectable		 3jb2A-1yixA:
13.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zcj PEROXISOMAL
BIFUNCTIONAL ENZYME

(Rattus
norvegicus) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 ILE A 313
GLY A 310
ALA A 380
PRO A 435
ALA A 335
 None
 0.89A 3jb2A-1zcjA:
3.1		 3jb2A-1zcjA:
17.86
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.
2b6n PROTEINASE K

(Serratia sp.
GF96) 		PF00082
(Peptidase_S8) 		5 ILE A  77
GLY A  78
GLY A  79
ALA A  53
VAL A  90
 None
 0.85A 3jb2A-2b6nA:
undetectable		 3jb2A-2b6nA:
13.92
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.
2c3o PYRUVATE-FERREDOXIN
OXIDOREDUCTASE

(Desulfovibrio
africanus) 		PF01558
(POR)
PF01855
(POR_N)
PF02775
(TPP_enzyme_C)
PF10371
(EKR)
PF13484
(Fer4_16)
PF17147
(PFOR_II) 		5 TYR A 498
GLY A 461
GLY A 462
ALA A 427
VAL A 677
 None
 0.96A 3jb2A-2c3oA:
undetectable		 3jb2A-2c3oA:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d4v ISOCITRATE
DEHYDROGENASE

(Acidithiobacillus
thiooxidans) 		PF00180
(Iso_dh) 		5 GLY A  38
ALA A 350
PRO A  43
ALA A  44
ALA A 355
 None
None
None
None
NAD  A2001 (-3.6A)
 0.92A 3jb2A-2d4vA:
undetectable		 3jb2A-2d4vA:
17.93
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.
2e6k TRANSKETOLASE

(Thermus
thermophilus) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		6 GLY A 121
GLY A 123
ALA A 127
ALA A 157
ALA A 408
VAL A 166
 None
 1.29A 3jb2A-2e6kA:
undetectable		 3jb2A-2e6kA:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2epj GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Aeropyrum
pernix) 		PF00202
(Aminotran_3) 		5 ILE A 273
GLY A 274
GLY A 275
ALA A 312
VAL A 279
 None
 0.81A 3jb2A-2epjA:
2.1		 3jb2A-2epjA:
18.50
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.
2eyq TRANSCRIPTION-REPAIR
COUPLING FACTOR

(Escherichia
coli) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02559
(CarD_CdnL_TRCF)
PF03461
(TRCF) 		5 ILE A 952
GLY A 535
ALA A 540
PHE A 972
ALA A 946
 None
 0.93A 3jb2A-2eyqA:
1.9		 3jb2A-2eyqA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ha9 UPF0210 PROTEIN
SP0239

(Streptococcus
pneumoniae) 		PF05167
(DUF711) 		5 ILE A 248
ALA A 256
PRO A  69
PHE A  18
VAL A 213
 None
 0.99A 3jb2A-2ha9A:
undetectable		 3jb2A-2ha9A:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hih LIPASE 46 KDA FORM

(Staphylococcus
hyicus) 		no annotation 5 TYR A  40
GLY A 127
GLY A 126
ALA A 174
PRO A 325
 None
 1.01A 3jb2A-2hihA:
undetectable		 3jb2A-2hihA:
17.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ipc PREPROTEIN
TRANSLOCASE SECA
SUBUNIT

(Thermus
thermophilus) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		5 ILE A  96
GLY A 383
ALA A 109
ALA A 206
VAL A 211
 None
 0.87A 3jb2A-2ipcA:
undetectable		 3jb2A-2ipcA:
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.
2ix4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Arabidopsis
thaliana) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 212
GLY A 395
ALA A 399
ALA A 454
ALA A 233
 None
 1.01A 3jb2A-2ix4A:
undetectable		 3jb2A-2ix4A:
17.15
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.
2ix4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Arabidopsis
thaliana) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ILE A 216
GLY A 234
GLY A 235
ALA A 126
ALA A 204
 None
 0.99A 3jb2A-2ix4A:
undetectable		 3jb2A-2ix4A:
17.15
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.
2ng1 SIGNAL SEQUENCE
RECOGNITION PROTEIN
FFH

(Thermus
aquaticus) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		6 ILE A 184
PRO A 129
ALA A 119
ALA A 133
VAL A 132
PRO A 155
 None
 1.36A 3jb2A-2ng1A:
undetectable		 3jb2A-2ng1A:
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.
2nli LACTATE OXIDASE

(Aerococcus
viridans) 		PF01070
(FMN_dh) 		5 ILE A  14
GLY A 330
GLY A 329
ALA A 100
ALA A 111
 None
 0.95A 3jb2A-2nliA:
undetectable		 3jb2A-2nliA:
16.79
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.
2o1s 1-DEOXY-D-XYLULOSE-5
-PHOSPHATE SYNTHASE

(Escherichia
coli) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
PF13292
(DXP_synthase_N) 		5 ILE A 423
GLY A 422
GLY A 433
PRO A 477
ALA A 560
 None
 0.87A 3jb2A-2o1sA:
3.3		 3jb2A-2o1sA:
20.81
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.
2ory LIPASE

(Photobacterium
sp. M37) 		PF01764
(Lipase_3) 		5 TYR A  74
ILE A 204
GLY A 172
ALA A 207
ALA A  11
 None
 1.00A 3jb2A-2oryA:
undetectable		 3jb2A-2oryA:
15.89
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.
2pl5 HOMOSERINE
O-ACETYLTRANSFERASE

(Leptospira
interrogans) 		PF00561
(Abhydrolase_1) 		5 ILE A  98
GLY A  99
GLY A 100
ALA A 280
PRO A 123
 None
 0.95A 3jb2A-2pl5A:
undetectable		 3jb2A-2pl5A:
17.20
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.
2qy1 PECTATE LYASE II

(Xanthomonas
campestris) 		PF00544
(Pec_lyase_C) 		5 ILE A 178
GLY A 177
GLY A 176
ALA A 136
VAL A 159
 None
 0.89A 3jb2A-2qy1A:
undetectable		 3jb2A-2qy1A:
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.
2rcy PYRROLINE
CARBOXYLATE
REDUCTASE

(Plasmodium
falciparum) 		PF03807
(F420_oxidored)
PF14748
(P5CR_dimer) 		5 ILE A 165
GLY A 169
ALA A 171
ALA A 249
VAL A 250
 None
 1.01A 3jb2A-2rcyA:
undetectable		 3jb2A-2rcyA:
13.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vda TRANSLOCASE SUBUNIT
SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		5 ILE A  99
GLY A 389
ALA A 112
ALA A 206
VAL A 211
 None
 0.88A 3jb2A-2vdaA:
undetectable		 3jb2A-2vdaA:
20.71
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.
2w55 XANTHINE
DEHYDROGENASE

(Rhodobacter
capsulatus) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 ILE B 722
GLY B 537
ALA B 469
ALA B 500
VAL B 499
 None
 0.88A 3jb2A-2w55B:
undetectable		 3jb2A-2w55B:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x58 PEROXISOMAL
BIFUNCTIONAL ENZYME

(Rattus
norvegicus) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 ILE A 313
GLY A 310
ALA A 380
PRO A 435
ALA A 335
 None
 0.96A 3jb2A-2x58A:
1.5		 3jb2A-2x58A:
21.14
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.
2zvi 2,3-DIKETO-5-METHYLT
HIOPENTYL-1-PHOSPHAT
E ENOLASE

(Bacillus
subtilis) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		5 GLY A 375
GLY A 374
ALA A 404
ALA A 360
ALA A 380
 None
 0.97A 3jb2A-2zviA:
undetectable		 3jb2A-2zviA:
16.83
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.
3bxz PREPROTEIN
TRANSLOCASE SUBUNIT
SECA

(Escherichia
coli) 		PF07517
(SecA_DEAD) 		5 ILE A  99
GLY A 389
ALA A 112
ALA A 206
VAL A 211
 None
 0.90A 3jb2A-3bxzA:
undetectable		 3jb2A-3bxzA:
17.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e60 3-OXOACYL-[ACYL-CARR
IER-PROTEIN ]
SYNTHASE II

(Bartonella
henselae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 173
GLY A 353
ALA A 357
ALA A 411
ALA A 194
 None
 0.98A 3jb2A-3e60A:
undetectable		 3jb2A-3e60A:
17.00
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.
3fch CARBOXYSOME SHELL
PROTEIN CSOS1D

(Prochlorococcus
marinus) 		PF00936
(BMC) 		5 ILE A 118
GLY A 124
ALA A 122
ALA A 223
VAL A 224
 None
 0.95A 3jb2A-3fchA:
undetectable		 3jb2A-3fchA:
15.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fch CARBOXYSOME SHELL
PROTEIN CSOS1D

(Prochlorococcus
marinus) 		PF00936
(BMC) 		5 ILE A 253
ALA A 207
PRO A 199
ALA A 200
VAL A  60
 None
 0.92A 3jb2A-3fchA:
undetectable		 3jb2A-3fchA:
15.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fdu PUTATIVE ENOYL-COA
HYDRATASE/ISOMERASE

(Acinetobacter
baumannii) 		PF00378
(ECH_1) 		5 GLY A 151
GLY A 152
ALA A 235
ALA A 102
PRO A  94
 None
None
None
None
GOL  A   1 (-4.3A)
 0.82A 3jb2A-3fduA:
undetectable		 3jb2A-3fduA:
13.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3foa TAIL SHEATH PROTEIN
GP18

(Escherichia
virus T4) 		PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N) 		6 GLY A 247
ALA A 267
ALA A 262
ALA A 280
VAL A 239
PRO A 253
 None
 1.41A 3jb2A-3foaA:
undetectable		 3jb2A-3foaA:
19.87
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.
3fpl NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Clostridium
beijerinckii;
Thermoanaerobacter
brockii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 155
GLY A 158
ALA A 162
ALA A 242
PRO A 177
 None
None
None
None
CL  A 354 (-3.6A)
 1.00A 3jb2A-3fplA:
2.8		 3jb2A-3fplA:
14.98
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.
3j2n TAIL SHEATH PROTEIN
GP18

(Escherichia
virus T4) 		PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N)
PF17482
(Phage_sheath_1C) 		6 GLY U 247
ALA U 267
ALA U 262
ALA U 280
VAL U 239
PRO U 253
 None
 1.41A 3jb2A-3j2nU:
undetectable		 3jb2A-3j2nU:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jru PROBABLE CYTOSOL
AMINOPEPTIDASE

(Xanthomonas
oryzae) 		no annotation 5 ILE B 293
GLY B 289
GLY B 288
ALA B 370
VAL B 312
 None
 0.93A 3jb2A-3jruB:
undetectable		 3jb2A-3jruB:
18.93
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.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		5 ILE A 546
GLY A 544
ALA A 584
PHE A 518
ALA A 491
 None
 0.99A 3jb2A-3k13A:
undetectable		 3jb2A-3k13A:
14.85
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.
3kcu PROBABLE FORMATE
TRANSPORTER 1

(Escherichia
coli) 		PF01226
(Form_Nir_trans) 		5 GLY A  72
GLY A  71
ALA A  67
VAL A 203
PRO A 198
 None
 1.00A 3jb2A-3kcuA:
undetectable		 3jb2A-3kcuA:
13.45
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.
3l09 PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Jannaschia sp.
CCS1) 		PF07848
(PaaX) 		5 GLY A 230
GLY A 229
PRO A 109
ALA A 110
ALA A 233
 None
 1.00A 3jb2A-3l09A:
undetectable		 3jb2A-3l09A:
14.07
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.
3l44 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
1

(Bacillus
anthracis) 		PF00202
(Aminotran_3) 		5 GLY A 275
GLY A 274
ALA A 315
PRO A 277
ALA A  72
 None
 0.89A 3jb2A-3l44A:
undetectable		 3jb2A-3l44A:
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.
3lkv UNCHARACTERIZED
CONSERVED DOMAIN
PROTEIN

(Vibrio cholerae) 		PF04392
(ABC_sub_bind) 		5 ILE A 162
GLY A 163
ALA A 194
ALA A 210
PRO A 241
 None
 0.88A 3jb2A-3lkvA:
undetectable		 3jb2A-3lkvA:
15.54
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.
3pty ARABINOSYLTRANSFERAS
E C

(Mycobacterium
tuberculosis) 		PF14896
(Arabino_trans_C) 		5 GLY A 789
ALA A 792
PRO A 787
PHE A 785
ALA A 856
 None
 0.94A 3jb2A-3ptyA:
undetectable		 3jb2A-3ptyA:
17.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sr6 XANTHINE
DEHYDROGENASE/OXIDAS
E

(Bos taurus) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 ILE C1253
GLY C1087
ALA C1019
ALA C1050
VAL C1049
 None
 0.77A 3jb2A-3sr6C:
undetectable		 3jb2A-3sr6C:
21.65
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.
3tij NUPC FAMILY PROTEIN

(Vibrio cholerae) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		6 GLY A 180
GLY A 179
ALA A 209
PRO A 158
ALA A 157
ALA A 367
 NA  A 421 ( 4.6A)
None
None
None
None
None
 1.45A 3jb2A-3tijA:
undetectable		 3jb2A-3tijA:
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.
3v0a NTNH

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		5 ILE B  83
PRO B  43
ALA B  42
ALA B  36
VAL B  35
 None
 1.00A 3jb2A-3v0aB:
undetectable		 3jb2A-3v0aB:
21.46
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.
3v4b STARVATION SENSING
PROTEIN RSPA

(Cellvibrio
japonicus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 286
GLY A 291
GLY A 290
ALA A  92
VAL A  91
 None
 0.97A 3jb2A-3v4bA:
undetectable		 3jb2A-3v4bA:
16.89
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.
3vuo NTNHA

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		5 ILE A  83
PRO A  43
ALA A  42
ALA A  36
VAL A  35
 None
 0.95A 3jb2A-3vuoA:
undetectable		 3jb2A-3vuoA:
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.
3zyv AOX3

(Mus musculus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 ILE A1258
GLY A1092
ALA A1024
ALA A1055
VAL A1054
 None
 0.82A 3jb2A-3zyvA:
undetectable		 3jb2A-3zyvA:
22.11
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.
4a01 PROTON
PYROPHOSPHATASE

(Vigna radiata) 		PF03030
(H_PPase) 		5 ILE A 725
GLY A 722
ALA A 693
ALA A 445
VAL A 448
 None
 0.98A 3jb2A-4a01A:
1.8		 3jb2A-4a01A:
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.
4aez WD REPEAT-CONTAINING
PROTEIN SLP1

(Schizosaccharomyces
pombe) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 TYR A 181
GLY A 322
GLY A 323
ALA A 351
VAL A 352
 None
 0.97A 3jb2A-4aezA:
undetectable		 3jb2A-4aezA:
17.81
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.
4b0t PUP--PROTEIN LIGASE

(Corynebacterium
glutamicum) 		PF03136
(Pup_ligase) 		5 ILE A  55
GLY A  58
ALA A 419
ALA A 409
ALA A  72
 None
None
None
None
ADP  A1478 ( 3.1A)
 1.01A 3jb2A-4b0tA:
undetectable		 3jb2A-4b0tA:
18.04
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.
4c60 OCHRATOXINASE

(Aspergillus
niger) 		PF01979
(Amidohydro_1) 		5 GLY A 290
GLY A 293
ALA A 297
PRO A 260
ALA A 311
 None
 0.96A 3jb2A-4c60A:
undetectable		 3jb2A-4c60A:
19.22
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.
4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE

(Sphingomonas
paucimobilis) 		PF04909
(Amidohydro_2) 		5 ILE A  90
GLY A 119
GLY A 118
ALA A 114
ALA A 101
 None
 1.00A 3jb2A-4diaA:
undetectable		 3jb2A-4diaA:
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.
4eye PROBABLE
OXIDOREDUCTASE

(Mycobacteroides
abscessus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ILE A  90
GLY A  91
GLY A  92
ALA A   3
ALA A  98
 None
 0.88A 3jb2A-4eyeA:
4.7		 3jb2A-4eyeA:
15.85
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.
4f9u CG32412

(Drosophila
melanogaster) 		PF04389
(Peptidase_M28) 		5 ILE A 220
GLY A 221
PHE A 314
ALA A 133
VAL A 134
 None
 0.94A 3jb2A-4f9uA:
undetectable		 3jb2A-4f9uA:
14.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gri GLUTAMATE--TRNA
LIGASE

(Borreliella
burgdorferi) 		PF00749
(tRNA-synt_1c) 		5 ILE A  18
GLY A  19
GLY A  20
ALA A 215
PHE A 314
 None
 0.92A 3jb2A-4griA:
undetectable		 3jb2A-4griA:
19.55
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.
4jn6 ACETALDEHYDE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF09290
(AcetDehyd-dimer) 		5 ILE B 133
GLY B 129
GLY B 128
ALA B 152
ALA B 175
 None
 0.96A 3jb2A-4jn6B:
2.8		 3jb2A-4jn6B:
15.47
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.
4jn6 ACETALDEHYDE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF09290
(AcetDehyd-dimer) 		5 ILE B 181
GLY B 182
GLY B 183
ALA B 185
ALA B 175
 None
 0.95A 3jb2A-4jn6B:
2.8		 3jb2A-4jn6B:
15.47
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.
4juu EPIMERASE

(Xanthomonas
campestris) 		PF05544
(Pro_racemase) 		6 ILE A 266
GLY A 265
GLY A 268
ALA A  12
PHE A 225
ALA A 222
 None
 1.37A 3jb2A-4juuA:
undetectable		 3jb2A-4juuA:
15.31
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.
4nur PSDSA

(Pseudomonas sp.
S9) 		PF00753
(Lactamase_B)
PF14863
(Alkyl_sulf_dimr)
PF14864
(Alkyl_sulf_C) 		5 TYR A 294
GLY A 156
GLY A 153
ALA A 187
VAL A 186
 None
 0.95A 3jb2A-4nurA:
undetectable		 3jb2A-4nurA:
20.15
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.
4nzs BETA-KETOTHIOLASE
BKTB

(Cupriavidus
necator) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ILE A 292
GLY A 291
ALA A 320
ALA A 166
VAL A 165
 None
 1.01A 3jb2A-4nzsA:
undetectable		 3jb2A-4nzsA:
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.
4pet EXTRACELLULAR
SOLUTE-BINDING
PROTEIN, FAMILY 7

(Colwellia
psychrerythraea) 		PF03480
(DctP) 		5 GLY A 152
GLY A 153
ALA A  52
PHE A 150
ALA A  99
 None
None
None
None
PYR  A 402 ( 4.4A)
 1.01A 3jb2A-4petA:
undetectable		 3jb2A-4petA:
15.28
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.
4qhr ALANINE RACEMASE

(Acinetobacter
baumannii) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		6 ILE A  66
GLY A  63
ALA A  90
PHE A  55
ALA A  58
VAL A  57
 None
None
None
None
LLP  A  34 ( 3.9A)
LLP  A  34 ( 4.8A)
 1.29A 3jb2A-4qhrA:
undetectable		 3jb2A-4qhrA:
15.89
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.
4rvh D-MYCAROSE
3-C-METHYLTRANSFERAS
E

(Streptomyces
argillaceus) 		PF08421
(Methyltransf_13)
PF08484
(Methyltransf_14)
PF13489
(Methyltransf_23) 		6 ILE A 113
GLY A 114
PRO A 136
ALA A 137
PHE A 156
VAL A 179
 SAH  A 502 (-4.7A)
SAH  A 502 (-3.5A)
SAH  A 502 (-4.0A)
SAH  A 502 ( 3.8A)
None
SAH  A 502 (-4.2A)
 0.82A 3jb2A-4rvhA:
7.0		 3jb2A-4rvhA:
16.82
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.
4tkt AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 ILE A3265
GLY A3266
GLY A3311
ALA A3333
ALA A3300
 None
 0.96A 3jb2A-4tktA:
undetectable		 3jb2A-4tktA:
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.
4us4 TRANSPORTER

(Bacillus
halodurans) 		PF00209
(SNF) 		6 ILE A  60
GLY A  59
ALA A 436
ALA A 228
ALA A  65
VAL A  63
 None
 1.48A 3jb2A-4us4A:
undetectable		 3jb2A-4us4A:
19.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ysw XANTHINE
DEHYDROGENASE/OXIDAS
E

(Rattus
norvegicus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		6 ILE A1253
GLY A1087
GLY A1089
ALA A1019
ALA A1050
VAL A1049
 None
 1.38A 3jb2A-4yswA:
undetectable		 3jb2A-4yswA:
21.70
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.
4ysw XANTHINE
DEHYDROGENASE/OXIDAS
E

(Rattus
norvegicus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 ILE A1253
GLY A1087
GLY A1089
ALA A1093
VAL A1049
 None
 1.01A 3jb2A-4yswA:
undetectable		 3jb2A-4yswA:
21.70
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.
5a8q PUTATIVE RETAINING
B-GLYCOSIDASE

(Saccharophagus
degradans) 		PF00150
(Cellulase) 		5 ILE A 244
ALA A 281
ALA A 228
VAL A 227
PRO A 225
 None
 0.92A 3jb2A-5a8qA:
undetectable		 3jb2A-5a8qA:
16.27
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.
5ah0 LIPASE

(Pelosinus
fermentans) 		no annotation 5 TYR A  40
GLY A 132
GLY A 131
ALA A 175
PRO A 341
 None
 0.93A 3jb2A-5ah0A:
undetectable		 3jb2A-5ah0A:
17.04
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.
5ce5 TRIACYLGLYCEROL
LIPASE

(Geobacillus
thermocatenulatus) 		no annotation 5 TYR A  30
GLY A 117
GLY A 116
ALA A 163
PRO A 329
 None
 0.93A 3jb2A-5ce5A:
undetectable		 3jb2A-5ce5A:
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.
5e6s INTEGRIN ALPHA-L

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 ILE A 560
ALA A   8
ALA A 578
VAL A 526
PRO A 519
 None
 0.88A 3jb2A-5e6sA:
undetectable		 3jb2A-5e6sA:
22.43
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.
5evj ARSENITE
METHYLTRANSFERASE

(Chlamydomonas
reinhardtii) 		PF13847
(Methyltransf_31) 		5 GLY A 238
ALA A 234
PRO A 277
ALA A 185
PRO A 191
 None
 0.98A 3jb2A-5evjA:
3.8		 3jb2A-5evjA:
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.
5i92 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Pseudomonas
aeruginosa) 		PF00202
(Aminotran_3) 		5 ILE A 267
GLY A 268
GLY A 269
ALA A 306
VAL A 273
 None
 0.94A 3jb2A-5i92A:
undetectable		 3jb2A-5i92A:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5inr DIPEPTIDASE

(Lactobacillus
farciminis) 		PF03577
(Peptidase_C69) 		5 ILE A 171
GLY A 172
GLY A 173
PRO A 154
VAL A 108
 None
 0.81A 3jb2A-5inrA:
undetectable		 3jb2A-5inrA:
18.70
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.
5jfc NADH-DEPENDENT
FERREDOXIN:NADP
OXIDOREDUCTASE
SUBUNIT ALPHA

(Pyrococcus
furiosus) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		5 ILE L 245
GLY L 246
ALA L 455
ALA L 162
ALA L 249
 None
None
FAD  L 503 (-3.5A)
None
None
 0.96A 3jb2A-5jfcL:
3.9		 3jb2A-5jfcL:
18.55
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.
5k9t PROTEIN TRANSLOCASE
SUBUNIT SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07517
(SecA_DEAD) 		5 ILE A  99
GLY A 389
ALA A 112
ALA A 206
VAL A 211
 None
 0.93A 3jb2A-5k9tA:
undetectable		 3jb2A-5k9tA:
19.48
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.
5l26 NUCLEOSIDE PERMEASE

(Neisseria
wadsworthii) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		6 GLY A 180
GLY A 179
ALA A 209
PRO A 158
ALA A 157
ALA A 367
 NA  A 506 ( 4.9A)
None
None
None
None
None
 1.42A 3jb2A-5l26A:
undetectable		 3jb2A-5l26A:
18.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum) 		PF12708
(Pectate_lyase_3) 		5 ILE A 542
GLY A 543
GLY A 544
ALA A 597
VAL A 609
 None
 0.97A 3jb2A-5m60A:
undetectable		 3jb2A-5m60A:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mq6 PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE-LIKE
PROTEIN

(Thermothelomyces
thermophila) 		PF07992
(Pyr_redox_2) 		6 ILE A 483
GLY A 484
GLY A 485
ALA A 513
ALA A 489
VAL A 490
 None
 1.06A 3jb2A-5mq6A:
undetectable		 3jb2A-5mq6A:
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.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		5 TYR A 390
ILE A 362
GLY A 361
GLY A 360
ALA A 386
 None
 0.83A 3jb2A-5n6uA:
undetectable		 3jb2A-5n6uA:
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.
5odr METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
A

(Methanothermococcus
thermolithotrophicus) 		PF00374
(NiFeSe_Hases) 		5 GLY F 170
GLY F 171
ALA F  88
ALA F  73
VAL F  82
 None
 0.99A 3jb2A-5odrF:
undetectable		 3jb2A-5odrF:
19.11
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.
5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)

(Neisseria
gonorrhoeae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ILE A 544
GLY A 541
GLY A 540
ALA A 473
VAL A 472
 None
 0.97A 3jb2A-5u25A:
3.4		 3jb2A-5u25A:
19.46
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.
5vj7 OXIDOREDUCTASE

(Pyrococcus
furiosus) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		5 ILE A 245
GLY A 246
ALA A 456
ALA A 162
ALA A 249
 None
None
FAD  A 503 (-2.7A)
FAD  A 503 (-4.8A)
None
 0.95A 3jb2A-5vj7A:
2.9		 3jb2A-5vj7A:
19.04
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.
5x9r CITRATE-SODIUM
SYMPORTER

(Klebsiella
pneumoniae) 		PF03390
(2HCT) 		6 ILE A 433
GLY A 432
GLY A 431
ALA A 188
ALA A 302
VAL A 296
 None
 1.44A 3jb2A-5x9rA:
undetectable		 3jb2A-5x9rA:
19.21
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.
5y2z LEUCINE-RICH
GLIOMA-INACTIVATED
PROTEIN 1

(Homo sapiens) 		no annotation 5 ILE B 278
GLY B 280
PHE B 318
ALA B 300
VAL B 299
 None
 0.95A 3jb2A-5y2zB:
undetectable		 3jb2A-5y2zB:
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.
5y31 LEUCINE-RICH
GLIOMA-INACTIVATED
PROTEIN 1

(Homo sapiens) 		no annotation 5 ILE B 278
GLY B 280
PHE B 318
ALA B 300
VAL B 299
 None
 0.96A 3jb2A-5y31B:
undetectable		 3jb2A-5y31B:
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.
5z7r SHORT-CHAIN-ENOYL-CO
A HYDRATASE

(Clostridium
acetobutylicum) 		no annotation 5 ILE A 115
GLY A 112
GLY A 111
ALA A  27
VAL A  63
 None
 0.92A 3jb2A-5z7rA:
undetectable		 3jb2A-5z7rA:
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.
6apx MALTOSE-BINDING
PERIPLASMIC
PROTEIN,DUAL
SPECIFICITY PROTEIN
PHOSPHATASE 1
MONOBODY YSX1

(Escherichia
coli;
Homo sapiens;
synthetic
construct) 		no annotation
no annotation 		5 TYR B  77
ILE A 329
GLY A 260
ALA A 109
PRO A 107
 None
 0.96A 3jb2A-6apxB:
undetectable		 3jb2A-6apxB:
7.18
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.
6bwc POLYSACCHARIDE
BIOSYNTHESIS PROTEIN
CAPD

(Bacillus
thuringiensis) 		no annotation 5 ILE A  17
GLY A  18
GLY A  15
ALA A  84
VAL A  83
 NAP  A 401 (-3.8A)
None
NAP  A 401 (-3.5A)
NAP  A 401 (-3.5A)
NAP  A 401 (-4.5A)
 1.01A 3jb2A-6bwcA:
3.4		 3jb2A-6bwcA:
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.
6eu6 AMMONIUM TRANSPORTER

(Candidatus
Kuenenia
stuttgartiensis) 		no annotation 5 ILE A 173
GLY A 175
ALA A 322
ALA A 180
ALA A 108
 None
 0.95A 3jb2A-6eu6A:
undetectable		 3jb2A-6eu6A:
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.
6upj HIV-2 PROTEASE

(Human
immunodeficiency
virus 2) 		PF00077
(RVP) 		5 ILE A  50
GLY A  49
GLY A  48
ALA A  28
PRO A  81
 NIU  A 100 (-3.9A)
NIU  A 100 ( 3.8A)
None
NIU  A 100 (-3.6A)
None
 1.00A 3jb2A-6upjA:
undetectable		 3jb2A-6upjA:
7.89
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.
1anu COHESIN-2

(Ruminiclostridium
thermocellum) 		PF00963
(Cohesin) 		3 ARG A  38
ASP A 133
ASP A 114
 None
 0.72A 3jb2A-1anuA:
0.0		 3jb2A-1anuA:
7.46
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.
1d2n N-ETHYLMALEIMIDE-SEN
SITIVE FUSION
PROTEIN

(Cricetulus
griseus) 		PF00004
(AAA) 		3 ARG A 615
ASP A 579
ASP A 612
 None
None
ANP  A   1 ( 4.3A)
 0.91A 3jb2A-1d2nA:
0.0		 3jb2A-1d2nA:
13.37
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.
1d5f E6AP HECT CATALYTIC
DOMAIN, E3 LIGASE

(Homo sapiens) 		PF00632
(HECT) 		3 ARG A 791
ASP A 607
ASP A 790
 None
 0.91A 3jb2A-1d5fA:
0.1		 3jb2A-1d5fA:
15.11
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.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 ARG A 234
ASP A 113
ASP A 231
 None
 0.72A 3jb2A-1gpeA:
0.0		 3jb2A-1gpeA:
20.21
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.
1hyh L-2-HYDROXYISOCAPROA
TE DEHYDROGENASE

(Weissella
confusa) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 ARG A 315
ASP A 323
ASP A 316
 None
 0.84A 3jb2A-1hyhA:
0.0		 3jb2A-1hyhA:
15.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mtp SERINE PROTEINASE
INHIBITOR (SERPIN),
CHAIN A
SERINE PROTEINASE
INHIBITOR (SERPIN),
CHAIN B

(Thermobifida
fusca;
Thermobifida
fusca) 		PF00079
(Serpin)
no annotation 		3 ARG A 306
ASP B 363
ASP A 308
 None
 0.90A 3jb2A-1mtpA:
0.0		 3jb2A-1mtpA:
15.48
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		3 ARG A 334
ASP A 348
ASP A 331
 None
 0.93A 3jb2A-1nneA:
3.7		 3jb2A-1nneA:
21.44
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.
1og6 HYPOTHETICAL
OXIDOREDUCTASE YDHF

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		3 ARG A 103
ASP A 135
ASP A 141
 None
 0.85A 3jb2A-1og6A:
0.0		 3jb2A-1og6A:
15.18
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.
1olt OXYGEN-INDEPENDENT
COPROPORPHYRINOGEN
III OXIDASE

(Escherichia
coli) 		PF04055
(Radical_SAM)
PF06969
(HemN_C) 		3 ARG A  47
ASP A 320
ASP A 334
 None
 0.86A 3jb2A-1oltA:
undetectable		 3jb2A-1oltA:
17.47
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.
1pgw BEAN POD MOTTLE
VIRUS LARGE (L)
SUBUNIT

(Bean pod mottle
virus) 		PF02247
(Como_LCP) 		3 ARG 2  57
ASP 2  61
ASP 2  22
 None
 0.82A 3jb2A-1pgw2:
undetectable		 3jb2A-1pgw2:
16.48
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.
1qf7 PROTEIN (CATALASE
HPII)

(Escherichia
coli) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		3 ARG A 521
ASP A 259
ASP A 525
 None
 0.93A 3jb2A-1qf7A:
undetectable		 3jb2A-1qf7A:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rdr POLIOVIRUS 3D
POLYMERASE

(Enterovirus C) 		PF00680
(RdRP_1) 		3 ARG A 408
ASP A 412
ASP A 406
 None
 0.78A 3jb2A-1rdrA:
undetectable		 3jb2A-1rdrA:
20.18
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.
1su3 INTERSTITIAL
COLLAGENASE

(Homo sapiens) 		PF00045
(Hemopexin)
PF00413
(Peptidase_M10)
PF01471
(PG_binding_1) 		3 ARG A 165
ASP A 124
ASP A 200
 None
CA  A 902 (-2.1A)
None
 0.82A 3jb2A-1su3A:
undetectable		 3jb2A-1su3A:
17.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2af5 ENGINEERED OUTER
SURFACE PROTEIN A
(OSPA) WITH THE
INSERTED TWO
BETA-HAIRPINS

(Borreliella
burgdorferi) 		PF00820
(Lipoprotein_1) 		3 ARG A 185
ASP A 164
ASP A 187
 None
 0.86A 3jb2A-2af5A:
undetectable		 3jb2A-2af5A:
14.26
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.
2d1p HYPOTHETICAL PROTEIN
YHEL

(Escherichia
coli) 		PF04077
(DsrH) 		3 ARG C  48
ASP C  39
ASP C  73
 None
 0.46A 3jb2A-2d1pC:
undetectable		 3jb2A-2d1pC:
6.93
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.
2d7i POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 10

(Homo sapiens) 		PF00535
(Glycos_transf_2)
PF00652
(Ricin_B_lectin) 		3 ARG A 189
ASP A 184
ASP A 188
 None
 0.93A 3jb2A-2d7iA:
2.1		 3jb2A-2d7iA:
18.86
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.
2di8 FILAMIN-B

(Homo sapiens) 		PF00630
(Filamin) 		3 ARG A  12
ASP A  38
ASP A  10
 None
 0.93A 3jb2A-2di8A:
undetectable		 3jb2A-2di8A:
6.74
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.
2dpn GLYCEROL KINASE

(Thermus
thermophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 ARG A  81
ASP A 164
ASP A 242
 None
 0.90A 3jb2A-2dpnA:
undetectable		 3jb2A-2dpnA:
18.60
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.
2e9f ARGININOSUCCINATE
LYASE

(Thermus
thermophilus) 		PF00206
(Lyase_1)
PF14698
(ASL_C2) 		3 ARG A 110
ASP A 117
ASP A  84
 None
 0.93A 3jb2A-2e9fA:
2.1		 3jb2A-2e9fA:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gi7 GPVI PROTEIN

(Homo sapiens) 		PF13895
(Ig_2) 		3 ARG A 166
ASP A 121
ASP A 167
 None
 0.82A 3jb2A-2gi7A:
undetectable		 3jb2A-2gi7A:
10.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hdi COLICIN I RECEPTOR

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 ARG A 180
ASP A 182
ASP A 179
 None
 0.76A 3jb2A-2hdiA:
undetectable		 3jb2A-2hdiA:
21.27
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.
2p91 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Aquifex
aeolicus) 		PF13561
(adh_short_C2) 		3 ARG A 152
ASP A 250
ASP A 101
 None
 0.87A 3jb2A-2p91A:
3.6		 3jb2A-2p91A:
14.74
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.
2poi BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 4

(Homo sapiens) 		PF00653
(BIR) 		3 ARG A  72
ASP A  77
ASP A  71
 None
 0.79A 3jb2A-2poiA:
undetectable		 3jb2A-2poiA:
6.30
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.
2poi BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 4

(Homo sapiens) 		PF00653
(BIR) 		3 ARG A  82
ASP A  59
ASP A  77
 None
 0.92A 3jb2A-2poiA:
undetectable		 3jb2A-2poiA:
6.30
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.
2r0h CGL3 LECTIN

(Coprinopsis
cinerea) 		PF00337
(Gal-bind_lectin) 		3 ARG A 109
ASP A 105
ASP A 108
 None
 0.89A 3jb2A-2r0hA:
undetectable		 3jb2A-2r0hA:
9.71
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.
2rgj FLAVIN-CONTAINING
MONOOXYGENASE

(Pseudomonas
aeruginosa) 		PF01494
(FAD_binding_3) 		3 ARG A 255
ASP A 261
ASP A 248
 None
 0.69A 3jb2A-2rgjA:
undetectable		 3jb2A-2rgjA:
17.70
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.
2x8u SERINE
PALMITOYLTRANSFERASE

(Sphingomonas
wittichii) 		PF00155
(Aminotran_1_2) 		3 ARG A 167
ASP A 135
ASP A 163
 None
 0.90A 3jb2A-2x8uA:
undetectable		 3jb2A-2x8uA:
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.
2yt0 AMYLOID BETA A4
PROTEIN AND AMYLOID
BETA A4 PRECURSOR
PROTEIN-BINDING
FAMILY B MEMBER 2

(Mus musculus) 		PF00640
(PID)
PF10515
(APP_amyloid) 		3 ARG A  76
ASP A  81
ASP A  75
 None
 0.64A 3jb2A-2yt0A:
undetectable		 3jb2A-2yt0A:
10.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3act CELLOBIOSE
PHOSPHORYLASE

(Cellulomonas
gilvus) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 ARG A   2
ASP A 701
ASP A 698
 None
 0.89A 3jb2A-3actA:
undetectable		 3jb2A-3actA:
23.35
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.
3cue TRANSPORT PROTEIN
PARTICLE 31 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF04051
(TRAPP) 		3 ARG B 272
ASP B 206
ASP B 276
 None
 0.94A 3jb2A-3cueB:
undetectable		 3jb2A-3cueB:
15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d3r HYDROGENASE ASSEMBLY
CHAPERONE HYPC/HUPF

(Shewanella
oneidensis) 		PF01455
(HupF_HypC) 		3 ARG A  16
ASP A  29
ASP A  13
 None
 0.66A 3jb2A-3d3rA:
undetectable		 3jb2A-3d3rA:
6.52
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.
3dlj BETA-ALA-HIS
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 ARG A 342
ASP A 233
ASP A 231
 None
None
UNX  A2010 ( 4.8A)
 0.66A 3jb2A-3dljA:
undetectable		 3jb2A-3dljA:
17.48
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.
3eex OUTER SURFACE
PROTEIN A

(Borreliella
burgdorferi) 		PF00820
(Lipoprotein_1) 		3 ARG A 208
ASP A 187
ASP A 210
 None
 0.80A 3jb2A-3eexA:
undetectable		 3jb2A-3eexA:
14.50
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.
3h2u RAVER-1

(Homo sapiens) 		PF00076
(RRM_1) 		3 ARG B 227
ASP B 283
ASP B 226
 None
 0.87A 3jb2A-3h2uB:
undetectable		 3jb2A-3h2uB:
12.92
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.
3if9 GLYCINE OXIDASE

(Bacillus
subtilis) 		PF01266
(DAO) 		3 ARG A 254
ASP A 232
ASP A 295
 None
 0.89A 3jb2A-3if9A:
2.1		 3jb2A-3if9A:
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.
3k0s DNA MISMATCH REPAIR
PROTEIN MUTS

(Escherichia
coli) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		3 ARG A 350
ASP A 364
ASP A 347
 None
 0.83A 3jb2A-3k0sA:
undetectable		 3jb2A-3k0sA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3klq PUTATIVE PILUS
ANCHORING PROTEIN

(Streptococcus
pyogenes) 		PF12892
(FctA) 		3 ARG A 104
ASP A  83
ASP A 107
 None
 0.88A 3jb2A-3klqA:
undetectable		 3jb2A-3klqA:
8.28
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.
3p4g ANTIFREEZE PROTEIN

(Marinomonas
primoryensis) 		no annotation 3 ARG A 185
ASP A 207
ASP A 167
 None
None
MG  A 326 (-2.4A)
 0.92A 3jb2A-3p4gA:
undetectable		 3jb2A-3p4gA:
15.86
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.
3qjp PUTATIVE
UNCHARACTERIZED
PROTEIN PH0350

(Pyrococcus
horikoshii) 		PF01881
(Cas_Cas6) 		3 ARG A 201
ASP A 153
ASP A 148
 A  R  10 ( 3.4A)
None
A  R  10 ( 4.0A)
 0.93A 3jb2A-3qjpA:
undetectable		 3jb2A-3qjpA:
12.68
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.
3rv2 S-ADENOSYLMETHIONINE
SYNTHASE

(Mycobacterium
marinum) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		3 ARG A  41
ASP A  37
ASP A 287
 None
 0.92A 3jb2A-3rv2A:
undetectable		 3jb2A-3rv2A:
17.72
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.
3ry7 RIBOKINASE

(Staphylococcus
aureus) 		PF00294
(PfkB) 		3 ARG A 263
ASP A 269
ASP A 273
 None
 0.91A 3jb2A-3ry7A:
2.4		 3jb2A-3ry7A:
15.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tsc PUTATIVE
OXIDOREDUCTASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		3 ARG A 148
ASP A 254
ASP A  99
 None
 0.75A 3jb2A-3tscA:
3.0		 3jb2A-3tscA:
14.97
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.
3tw8 RAS-RELATED PROTEIN
RAB-35

(Homo sapiens) 		PF00071
(Ras) 		3 ARG B 127
ASP B  89
ASP B 124
 None
 0.78A 3jb2A-3tw8B:
undetectable		 3jb2A-3tw8B:
10.86
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.
3ufb TYPE I
RESTRICTION-MODIFICA
TION SYSTEM
METHYLTRANSFERASE
SUBUNIT

(Vibrio
vulnificus) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		3 ARG A 150
ASP A  36
ASP A  44
 None
 0.75A 3jb2A-3ufbA:
7.2		 3jb2A-3ufbA:
19.45
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.
3ugv ENOLASE

(alpha
proteobacterium
BAL199) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 ARG A  26
ASP A 182
ASP A 177
 None
 0.91A 3jb2A-3ugvA:
undetectable		 3jb2A-3ugvA:
16.90
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.
3ulx STRESS-INDUCED
TRANSCRIPTION FACTOR
NAC1

(Oryza sativa) 		PF02365
(NAM) 		3 ARG A  76
ASP A 157
ASP A  77
 None
 0.85A 3jb2A-3ulxA:
undetectable		 3jb2A-3ulxA:
9.68
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.
3voh CELLOBIOHYDROLASE

(Coprinopsis
cinerea) 		PF01341
(Glyco_hydro_6) 		3 ARG A 190
ASP A 159
ASP A 186
 None
 0.91A 3jb2A-3vohA:
undetectable		 3jb2A-3vohA:
15.75
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.
4as5 INOSITOL
MONOPHOSPHATASE 1

(Mus musculus) 		PF00459
(Inositol_P) 		3 ARG A 248
ASP A 244
ASP A 274
 None
 0.93A 3jb2A-4as5A:
undetectable		 3jb2A-4as5A:
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.
4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE

(Ralstonia sp.
DSMZ 6428) 		PF13561
(adh_short_C2) 		3 ARG A 113
ASP A  60
ASP A 109
 None
NAP  A1250 (-3.3A)
None
 0.90A 3jb2A-4bmsA:
3.5		 3jb2A-4bmsA:
13.58
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.
4bsz ANKYRIN
REPEAT-CONTAINING
PROTEIN YAR1

(Saccharomyces
cerevisiae) 		PF12796
(Ank_2) 		3 ARG B 123
ASP B 119
ASP B 129
 None
 0.85A 3jb2A-4bszB:
undetectable		 3jb2A-4bszB:
11.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c3h DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA190

(Saccharomyces
cerevisiae) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 ARG A1295
ASP A1298
ASP A1268
 None
 0.74A 3jb2A-4c3hA:
undetectable		 3jb2A-4c3hA:
21.27
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.
4i9f GLYCEROL 3-PHOSPHATE
PHOSPHATASE

(Mycobacterium
tuberculosis) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		3 ARG A 210
ASP A 237
ASP A 212
 None
 0.89A 3jb2A-4i9fA:
undetectable		 3jb2A-4i9fA:
16.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j7q PHOSPHATIDYLINOSITOL
TRANSFER PROTEIN
PDR16

(Saccharomyces
cerevisiae) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		3 ARG A 309
ASP A 186
ASP A 313
 None
 0.81A 3jb2A-4j7qA:
undetectable		 3jb2A-4j7qA:
16.00
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.
4lq1 1,4-ALPHA-GLUCAN
BRANCHING ENZYME
GLGB

(Escherichia
coli) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		3 ARG A 315
ASP A 323
ASP A 316
 None
 0.86A 3jb2A-4lq1A:
undetectable		 3jb2A-4lq1A:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lxf TREHALOSE SYNTHASE

(Mycobacterium
tuberculosis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 ARG A 225
ASP A  27
ASP A 222
 None
 0.91A 3jb2A-4lxfA:
undetectable		 3jb2A-4lxfA:
18.62
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.
4o2t UNCHARACTERIZED
PROTEIN

(Parabacteroides
distasonis) 		PF16109
(DUF4827) 		3 ARG A 154
ASP A  76
ASP A 153
 None
 0.86A 3jb2A-4o2tA:
undetectable		 3jb2A-4o2tA:
9.86
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.
4ow2 YOP EFFECTOR YOPM

(Yersinia
enterocolitica) 		PF12468
(TTSSLRR) 		3 ARG A 402
ASP A 419
ASP A 422
 None
 0.78A 3jb2A-4ow2A:
undetectable		 3jb2A-4ow2A:
17.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oxc E3 UBIQUITIN-PROTEIN
LIGASE XIAP

(Homo sapiens) 		PF00653
(BIR) 		3 ARG A  72
ASP A  77
ASP A  71
 None
 0.81A 3jb2A-4oxcA:
undetectable		 3jb2A-4oxcA:
7.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13229
(Beta_helix) 		3 ARG A 369
ASP A 317
ASP A 368
 None
 0.72A 3jb2A-4ozyA:
undetectable		 3jb2A-4ozyA:
17.04
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.
4pmd ENDO-1,4-BETA-XYLANA
SE

(Caldicellulosiruptor
bescii) 		PF00331
(Glyco_hydro_10) 		3 ARG A 259
ASP A 316
ASP A 257
 None
 0.67A 3jb2A-4pmdA:
undetectable		 3jb2A-4pmdA:
16.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rfp ACIDIC PHOSPHOLIPASE
A2 5

(Trimeresurus
stejnegeri) 		PF00068
(Phospholip_A2_1) 		3 ARG A  97
ASP A 101
ASP A  98
 None
 0.87A 3jb2A-4rfpA:
undetectable		 3jb2A-4rfpA:
7.44
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.
4u48 PUTATIVE INNER
MEMBRANE LIPOPROTEIN

(Salmonella
enterica) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
PF11974
(MG1) 		3 ARG A1367
ASP A1379
ASP A1365
 None
 0.92A 3jb2A-4u48A:
undetectable		 3jb2A-4u48A:
21.23
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.
4yhb IRON-CHELATOR
UTILIZATION PROTEIN

(Thermobifida
fusca) 		PF04954
(SIP)
PF08021
(FAD_binding_9) 		3 ARG A  92
ASP A  36
ASP A 104
 None
 0.79A 3jb2A-4yhbA:
4.3		 3jb2A-4yhbA:
14.30
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.
5a5t EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT A

(Oryctolagus
cuniculus) 		PF01399
(PCI) 		3 ARG A 476
ASP A 479
ASP A 473
 None
 0.82A 3jb2A-5a5tA:
2.0		 3jb2A-5a5tA:
19.74
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.
5cb7 OUTER CAPSID PROTEIN
VP4

(Rotavirus A) 		no annotation 3 ARG A 170
ASP A 195
ASP A 171
 None
 0.69A 3jb2A-5cb7A:
undetectable		 3jb2A-5cb7A:
10.77
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.
5ce9 POLYPHENOL OXIDASE

(Juglans regia) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		3 ARG A 314
ASP A 319
ASP A  35
 None
 0.78A 3jb2A-5ce9A:
undetectable		 3jb2A-5ce9A:
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.
5cgz 4-OXALMESACONATE
HYDRATASE

(Pseudomonas
putida) 		PF02585
(PIG-L) 		3 ARG A  46
ASP A  86
ASP A  89
 None
GOL  A 308 (-3.3A)
None
 0.83A 3jb2A-5cgzA:
2.4		 3jb2A-5cgzA:
12.52
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.
5d4w PUTATIVE HEAT SHOCK
PROTEIN

(Chaetomium
thermophilum) 		PF00004
(AAA)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		3 ARG A 823
ASP A 820
ASP A 822
 None
 0.92A 3jb2A-5d4wA:
2.2		 3jb2A-5d4wA:
22.47
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.
5dan 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE

(Thermotoga
maritima) 		PF00248
(Aldo_ket_red) 		3 ARG A 151
ASP A 168
ASP A 182
 None
 0.68A 3jb2A-5danA:
undetectable		 3jb2A-5danA:
13.89
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.
5dux GALECTIN-4

(Homo sapiens) 		no annotation 3 ARG B  67
ASP B 141
ASP B  69
 LAT  B 201 (-2.6A)
None
None
 0.74A 3jb2A-5duxB:
undetectable		 3jb2A-5duxB:
9.11
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.
5e2h BETA-LACTAMASE

(Mycolicibacterium
smegmatis) 		PF00144
(Beta-lactamase) 		3 ARG A  50
ASP A 224
ASP A  51
 None
 0.91A 3jb2A-5e2hA:
undetectable		 3jb2A-5e2hA:
15.67
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.
5ggg PROTEIN
O-LINKED-MANNOSE
BETA-1,2-N-ACETYLGLU
COSAMINYLTRANSFERASE
1

(Homo sapiens) 		PF03071
(GNT-I)
PF15711
(ILEI) 		3 ARG A 129
ASP A 122
ASP A 179
 None
 0.75A 3jb2A-5gggA:
undetectable		 3jb2A-5gggA:
18.22
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.
5gju ATP-DEPENDENT RNA
HELICASE DEAD

(Escherichia
coli) 		PF00270
(DEAD) 		3 ARG A 135
ASP A 169
ASP A 138
 None
 0.88A 3jb2A-5gjuA:
undetectable		 3jb2A-5gjuA:
11.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hcd RHIPICEPHALUS
MICROPLUS RACI2

(Rhipicephalus
microplus) 		no annotation 3 ARG D  29
ASP D  24
ASP D  49
 None
 0.92A 3jb2A-5hcdD:
undetectable		 3jb2A-5hcdD:
6.45
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.
5hqb ALPHA-GLUCOSIDASE

(Pseudoalteromonas
sp. K8) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		3 ARG A 594
ASP A 597
ASP A 572
 None
 0.72A 3jb2A-5hqbA:
undetectable		 3jb2A-5hqbA:
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.
5idu ACYL-COA
DEHYDROGENASE DOMAIN
PROTEIN

(Paraburkholderia
phymatum) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 ARG A 221
ASP A 141
ASP A 165
 None
 0.86A 3jb2A-5iduA:
undetectable		 3jb2A-5iduA:
16.79
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.
5ivl DEAD-BOX
ATP-DEPENDENT RNA
HELICASE CSHA

(Geobacillus
stearothermophilus) 		no annotation 3 ARG B 130
ASP B 164
ASP B 133
 None
 0.89A 3jb2A-5ivlB:
3.0		 3jb2A-5ivlB:
16.92
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.
5jxu DYP-TYPE PEROXIDASE
FAMILY

(Thermomonospora
curvata) 		PF04261
(Dyp_perox) 		3 ARG A  97
ASP A 185
ASP A  93
 None
 0.89A 3jb2A-5jxuA:
undetectable		 3jb2A-5jxuA:
16.97
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.
5k3j ACYL-COENZYME A
OXIDASE

(Caenorhabditis
elegans) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		3 ARG A  90
ASP A 115
ASP A  91
 None
 0.88A 3jb2A-5k3jA:
undetectable		 3jb2A-5k3jA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kd0 AROMATIC
PRENYLTRANSFERASE

(Aspergillus
terreus) 		PF11991
(Trp_DMAT) 		3 ARG A 104
ASP A 182
ASP A 179
 GST  A 502 ( 3.4A)
None
GST  A 502 ( 4.4A)
 0.88A 3jb2A-5kd0A:
undetectable		 3jb2A-5kd0A:
17.73
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.
5mqm GLYCOSYL HYDROLASES
FAMILY 2, SUGAR
BINDING DOMAIN

(Bacteroides
thetaiotaomicron) 		PF17132
(Glyco_hydro_106) 		3 ARG A 637
ASP A 653
ASP A 636
 None
 0.72A 3jb2A-5mqmA:
undetectable		 3jb2A-5mqmA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mzn HELICASE
SEN1,HELICASE SEN1

(Saccharomyces
cerevisiae) 		PF13086
(AAA_11)
PF13087
(AAA_12) 		3 ARG A1841
ASP A1849
ASP A1842
 None
GOL  A2049 ( 4.6A)
None
 0.72A 3jb2A-5mznA:
3.3		 3jb2A-5mznA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ols RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 ARG A 174
ASP A 177
ASP A 142
 None
 0.83A 3jb2A-5olsA:
undetectable		 3jb2A-5olsA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oyd CELLULASE, PUTATIVE,
CEL5D

(Cellvibrio
japonicus) 		no annotation 3 ARG A 425
ASP A 381
ASP A 373
 None
 0.66A 3jb2A-5oydA:
undetectable		 3jb2A-5oydA:
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.
5ttd MALTOSE-BINDING
PERIPLASMIC
PROTEIN,PILIN
ISOPEPTIDE LINKAGE
DOMAIN PROTEIN

(Escherichia
coli;
Streptococcus
pyogenes) 		PF12892
(FctA)
PF13416
(SBP_bac_8) 		3 ARG A 481
ASP A 460
ASP A 484
 None
 0.88A 3jb2A-5ttdA:
undetectable		 3jb2A-5ttdA:
18.48
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.
5vyl INNER TEGUMENT
PROTEIN

(Human
alphaherpesvirus
1) 		PF03970
(Herpes_UL37_1) 		3 ARG A  28
ASP A  79
ASP A  23
 None
 0.87A 3jb2A-5vylA:
2.2		 3jb2A-5vylA:
21.72
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.
5whz ANTI-HIV CODV-FAB
HEAVY CHAIN
ANTI-HIV CODV-FAB
LIGHT CHAIN

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		3 ARG L 214
ASP L 209
ASP H  61
 None
 0.90A 3jb2A-5whzL:
undetectable		 3jb2A-5whzL:
15.55
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.
5x6a ENDOGLUCANASE,
PUTATIVE

(Aspergillus
fumigatus) 		no annotation 3 ARG A  58
ASP A  45
ASP A  53
 None
 0.62A 3jb2A-5x6aA:
undetectable		 3jb2A-5x6aA:
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.
5x9w DNA MISMATCH REPAIR
PROTEIN MUTS

(Neisseria
gonorrhoeae) 		no annotation 3 ARG A 346
ASP A 360
ASP A 343
 None
 0.90A 3jb2A-5x9wA:
2.0		 3jb2A-5x9wA:
23.19
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.
5xox TRNA(HIS)
GUANYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF04446
(Thg1)
PF14413
(Thg1C) 		3 ARG A 133
ASP A  77
ASP A 131
 None
GTP  A 301 (-2.4A)
None
 0.70A 3jb2A-5xoxA:
undetectable		 3jb2A-5xoxA:
12.21
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.
5xyf TERF1-INTERACTING
NUCLEAR FACTOR 2

(Homo sapiens) 		no annotation 3 ARG A  52
ASP A  96
ASP A 103
 None
 0.79A 3jb2A-5xyfA:
undetectable		 3jb2A-5xyfA:
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.
5y3x BETA-XYLANASE

(Caldicellulosiruptor
owensensis) 		no annotation 3 ARG A 259
ASP A 316
ASP A 257
 None
 0.66A 3jb2A-5y3xA:
undetectable		 3jb2A-5y3xA:
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.
5ygu DIAMINOPIMELATE
EPIMERASE

(Escherichia
coli) 		no annotation 3 ARG A  96
ASP A  53
ASP A  57
 None
 0.89A 3jb2A-5yguA:
undetectable		 3jb2A-5yguA:
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.
6byi BETA-MANNOSIDASE

(Xanthomonas
citri) 		no annotation 3 ARG A 341
ASP A 425
ASP A 465
 None
 0.94A 3jb2A-6byiA:
undetectable		 3jb2A-6byiA:
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.
6c1q SOLUBLE CYTOCHROME
B562, C5A
ANAPHYLATOXIN
CHEMOTACTIC RECEPTOR
1 CHIMERA

(Escherichia
coli;
Homo sapiens) 		no annotation 3 ARG B 284
ASP B 277
ASP B 281
 None
 0.84A 3jb2A-6c1qB:
undetectable		 3jb2A-6c1qB:
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.
6cfw MEMBRANE-BOUND
HYDROGENASE SUBUNIT
ALPHA

(Pyrococcus
furiosus) 		no annotation 3 ARG L 201
ASP L 263
ASP L 202
 None
 0.77A 3jb2A-6cfwL:
undetectable		 3jb2A-6cfwL:
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.
6es9 ACYL-COA
DEHYDROGENASE

(Paracoccus
denitrificans) 		no annotation 3 ARG A 342
ASP A 335
ASP A 340
 None
 0.91A 3jb2A-6es9A:
2.2		 3jb2A-6es9A:
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.
6ft5 -

(-) 		no annotation 3 ARG A  68
ASP A  63
ASP A  94
 GOL  A 502 (-3.9A)
None
GOL  A 501 ( 4.8A)
 0.91A 3jb2A-6ft5A:
undetectable		 3jb2A-6ft5A:
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.
6fzv PROCOLLAGEN
C-ENDOPEPTIDASE
ENHANCER 1

(Homo sapiens) 		no annotation 3 ARG D 189
ASP D 233
ASP D 185
 None
CA  D 302 (-3.1A)
None
 0.84A 3jb2A-6fzvD:
undetectable		 3jb2A-6fzvD:
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.
6g72 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
7, MITOCHONDRIAL
NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Mus musculus;
Mus musculus) 		no annotation
no annotation 		3 ARG B  51
ASP H  51
ASP B  94
 None
 0.84A 3jb2A-6g72B:
undetectable		 3jb2A-6g72B:
undetectable