SIMILAR PATTERNS OF AMINO ACIDS FOR 5MM4_B_TA1B501_1

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.
1e5r PROLINE OXIDASE

(Streptomyces
sp. TH1) 		PF05118
(Asp_Arg_Hydrox)
PF05373
(Pro_3_hydrox_C) 		5 VAL A 126
GLU A 128
HIS A 135
ALA A 133
SER A 130
 None
 1.07A 5mm4B-1e5rA:
undetectable		 5mm4B-1e5rA:
13.54
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.
1fcp PROTEIN (FERRIC
HYDROXAMATE UPTAKE
RECEPTOR)

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 VAL A 152
GLU A 127
LEU A 375
ALA A  21
THR A 295
 None
 1.37A 5mm4B-1fcpA:
undetectable		 5mm4B-1fcpA:
8.31
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.
1ile ISOLEUCYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		5 GLU A 731
LEU A 793
ALA A 739
PRO A 662
LEU A 664
 None
 1.18A 5mm4B-1ileA:
0.8		 5mm4B-1ileA:
6.58
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.
1jr1 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE 2

(Cricetulus
griseus) 		PF00478
(IMPDH)
PF00571
(CBS) 		5 VAL A 323
ALA A 381
SER A 351
THR A  63
PRO A 360
 None
 1.44A 5mm4B-1jr1A:
0.7		 5mm4B-1jr1A:
10.47
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.
1l8f ENDOGLUCANASE

(Melanocarpus
albomyces) 		PF02015
(Glyco_hydro_45) 		5 VAL A 186
GLU A 184
PHE A 119
THR A 110
LEU A  76
 None
 1.38A 5mm4B-1l8fA:
undetectable		 5mm4B-1l8fA:
15.66
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.
1lzk HEROIN ESTERASE

(Rhodococcus sp.) 		PF07859
(Abhydrolase_3) 		5 VAL A 170
ALA A 166
THR A 256
PRO A 240
LEU A 191
 None
 1.18A 5mm4B-1lzkA:
3.4		 5mm4B-1lzkA:
14.95
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.
1on9 METHYLMALONYL-COA
CARBOXYLTRANSFERASE
12S SUBUNIT

(Propionibacterium
freudenreichii) 		PF01039
(Carboxyl_trans) 		5 VAL A 267
ALA A 264
SER A 328
THR A 132
LEU A 253
 None
 1.24A 5mm4B-1on9A:
undetectable		 5mm4B-1on9A:
9.39
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.
1pn4 PEROXISOMAL
HYDRATASE-DEHYDROGEN
ASE-EPIMERASE

(Candida
tropicalis) 		PF01575
(MaoC_dehydratas) 		5 ALA A  60
PHE A  59
THR A 130
PRO A  68
LEU A  71
 None
None
HDC  A1277 ( 4.9A)
EDO  A 504 (-4.6A)
EDO  A 504 (-4.1A)
 1.45A 5mm4B-1pn4A:
undetectable		 5mm4B-1pn4A:
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.
1qy9 HYPOTHETICAL PROTEIN
YDDE

(Escherichia
coli) 		PF02567
(PhzC-PhzF) 		5 HIS A   7
ALA A  21
SER A  45
THR A 284
PRO A 223
 None
 1.40A 5mm4B-1qy9A:
undetectable		 5mm4B-1qy9A:
13.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sb3 4-HYDROXYBENZOYL-COA
REDUCTASE ALPHA
SUBUNIT

(Thauera
aromatica) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 VAL A 159
HIS A 342
ALA A 161
PHE A 163
THR A 400
 None
 1.23A 5mm4B-1sb3A:
undetectable		 5mm4B-1sb3A:
7.66
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.
1tkc TRANSKETOLASE

(Saccharomyces
cerevisiae) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 VAL A 446
ALA A 467
THR A 562
PRO A 483
LEU A 618
 None
 1.15A 5mm4B-1tkcA:
2.7		 5mm4B-1tkcA:
10.23
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.
1vdk FUMARATE HYDRATASE
CLASS II

(Thermus
thermophilus) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 GLU A  44
LEU A 358
ALA A 366
THR A  97
PRO A  42
 None
 1.28A 5mm4B-1vdkA:
undetectable		 5mm4B-1vdkA:
10.52
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.
1xls ORPHAN NUCLEAR
RECEPTOR NR1I3

(Mus musculus) 		PF00104
(Hormone_recep) 		5 LEU E 253
ALA E 242
PHE E 171
PRO E 148
LEU E 151
 None
None
TCD  E 805 ( 4.7A)
None
None
 1.32A 5mm4B-1xlsE:
undetectable		 5mm4B-1xlsE:
13.22
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.
2b4g DIHYDROOROTATE
DEHYDROGENASE

(Trypanosoma
brucei) 		PF01180
(DHO_dh) 		5 VAL A 252
ALA A 258
THR A 295
PRO A  15
LEU A   3
 None
 1.41A 5mm4B-2b4gA:
0.5		 5mm4B-2b4gA:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2du3 O-PHOSPHOSERYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF01409
(tRNA-synt_2d) 		5 VAL A 476
GLU A 477
LEU A 425
ALA A 472
PRO A 372
 None
 1.44A 5mm4B-2du3A:
undetectable		 5mm4B-2du3A:
10.61
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.
2epk N-ACETYL-BETA-D-GLUC
OSAMINIDASE

(Streptococcus
gordonii) 		PF00728
(Glyco_hydro_20) 		5 LEU X 121
ALA X 337
SER X 350
PRO X 388
LEU X 387
 None
 1.42A 5mm4B-2epkX:
1.5		 5mm4B-2epkX:
10.57
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.
2exa PENICILLIN-BINDING
PROTEIN 4

(Escherichia
coli) 		PF02113
(Peptidase_S13) 		5 LEU A 340
ALA A 428
THR A  68
PRO A 391
LEU A 303
 None
 1.31A 5mm4B-2exaA:
undetectable		 5mm4B-2exaA:
10.83
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.
2f9i ACETYL-COENZYME A
CARBOXYLASE CARBOXYL
TRANSFERASE SUBUNIT
BETA

(Staphylococcus
aureus) 		PF01039
(Carboxyl_trans) 		5 VAL B 111
ALA B 126
PHE B 159
THR B 153
LEU B 187
 None
 1.36A 5mm4B-2f9iB:
2.5		 5mm4B-2f9iB:
15.94
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.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		5 VAL A 308
LEU A 248
ALA A 305
PHE A 120
LEU A 220
 None
None
HEM  A 600 (-3.6A)
HEM  A 600 (-4.6A)
None
 1.28A 5mm4B-2f9qA:
undetectable		 5mm4B-2f9qA:
10.42
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.
2fq1 ISOCHORISMATASE

(Escherichia
coli) 		PF00550
(PP-binding)
PF00857
(Isochorismatase) 		5 LEU A 112
ALA A 153
SER A 189
PRO A  12
LEU A  11
 None
 1.31A 5mm4B-2fq1A:
3.7		 5mm4B-2fq1A:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g3n ALPHA-GLUCOSIDASE

(Sulfolobus
solfataricus) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		5 VAL A 124
GLU A 142
LEU A 434
PHE A 117
PRO A  23
 None
 1.42A 5mm4B-2g3nA:
0.6		 5mm4B-2g3nA:
9.20
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.
2gep SULFITE REDUCTASE
HEMOPROTEIN

(Escherichia
coli) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 LEU A 398
ALA A 103
PHE A 122
THR A 119
LEU A 137
 None
None
None
SRM  A 580 (-4.2A)
None
 1.09A 5mm4B-2gepA:
undetectable		 5mm4B-2gepA:
9.15
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.
2hpg ABC TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF03480
(DctP) 		5 LEU A 139
ALA A 183
SER A 187
THR A  87
LEU A 242
 None
 1.42A 5mm4B-2hpgA:
undetectable		 5mm4B-2hpgA:
12.42
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.
2jqz E3 UBIQUITIN-PROTEIN
LIGASE SMURF2

(Homo sapiens) 		PF00168
(C2) 		5 VAL A  18
LEU A 120
ALA A  37
PRO A  59
LEU A  24
 None
 1.11A 5mm4B-2jqzA:
undetectable		 5mm4B-2jqzA:
21.01
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.
2kt7 PUTATIVE
PEPTIDOGLYCAN BOUND
PROTEIN (LPXTG
MOTIF)

(Listeria
monocytogenes) 		PF06458
(MucBP) 		5 VAL A  43
ALA A  83
SER A  66
PRO A  68
LEU A  76
 None
 1.41A 5mm4B-2kt7A:
undetectable		 5mm4B-2kt7A:
18.92
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.
2mas INOSINE-URIDINE
NUCLEOSIDE
N-RIBOHYDROLASE

(Crithidia
fasciculata) 		PF01156
(IU_nuc_hydro) 		5 VAL A  36
LEU A 272
THR A 275
PRO A 125
LEU A 151
 None
 1.38A 5mm4B-2masA:
3.3		 5mm4B-2masA:
15.02
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.
2r87 PURP PROTEIN PF1517

(Pyrococcus
furiosus) 		PF06849
(DUF1246)
PF06973
(DUF1297) 		5 GLU A  26
LEU A  76
ALA A  64
THR A  69
LEU A  17
 None
 1.46A 5mm4B-2r87A:
2.8		 5mm4B-2r87A:
14.67
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		5 GLU G 121
PHE G  37
THR G  10
PRO G  54
LEU G  60
 None
 1.34A 5mm4B-2uv8G:
undetectable		 5mm4B-2uv8G:
3.60
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.
2yc2 SMALL RAB-RELATED
GTPASE

(Chlamydomonas
reinhardtii) 		PF00071
(Ras) 		5 VAL C 102
ALA C 135
SER C 167
PHE C 163
THR C 157
 None
 1.42A 5mm4B-2yc2C:
undetectable		 5mm4B-2yc2C:
23.53
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.
2zd2 ATP12 ATPASE

(Paracoccus
denitrificans) 		PF07542
(ATP12) 		5 VAL A1185
LEU A1071
ALA A1192
PRO A1176
LEU A1175
 None
 1.29A 5mm4B-2zd2A:
undetectable		 5mm4B-2zd2A:
14.72
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.
2zm5 TRNA
DELTA(2)-ISOPENTENYL
PYROPHOSPHATE
TRANSFERASE

(Escherichia
coli) 		PF01715
(IPPT) 		5 GLU A  61
LEU A 286
THR A 108
PRO A  57
LEU A  45
 None
None
A  C  37 ( 2.9A)
None
A  C  37 ( 4.6A)
 1.44A 5mm4B-2zm5A:
undetectable		 5mm4B-2zm5A:
14.00
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.
3b0b CENTROMERE PROTEIN S
CENTROMERE PROTEIN X

(Gallus gallus) 		PF09415
(CENP-X)
no annotation 		5 LEU B  12
HIS C  20
ALA B  59
THR C  12
LEU C  40
 None
 1.11A 5mm4B-3b0bB:
undetectable		 5mm4B-3b0bB:
18.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cze SUCROSE HYDROLASE

(Xanthomonas
citri) 		PF00128
(Alpha-amylase) 		5 VAL A  63
GLU A  62
ALA A 263
PHE A 259
THR A 301
 None
 1.44A 5mm4B-3czeA:
undetectable		 5mm4B-3czeA:
8.86
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.
3dte IRRE PROTEIN

(Deinococcus
deserti) 		PF06114
(Peptidase_M78) 		5 LEU A 147
ALA A 120
SER A  85
PHE A  78
THR A 156
 None
 1.27A 5mm4B-3dteA:
undetectable		 5mm4B-3dteA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ee1 EFFECTOR PROTEIN
VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		5 VAL A 344
LEU A 219
ALA A 277
SER A 346
PHE A 278
 None
 1.39A 5mm4B-3ee1A:
undetectable		 5mm4B-3ee1A:
11.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ee1 EFFECTOR PROTEIN
VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		5 VAL A 344
LEU A 231
ALA A 277
SER A 346
PHE A 278
 None
 1.24A 5mm4B-3ee1A:
undetectable		 5mm4B-3ee1A:
11.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3evr MYOSIN LIGHT CHAIN
KINASE, GREEN
FLUORESCENT PROTEIN,
CALMODULIN-1 CHIMERA

(Aequorea
victoria;
Rattus
norvegicus) 		PF01353
(GFP)
PF13499
(EF-hand_7) 		5 LEU A 307
HIS A  49
ALA A 318
PHE A 371
THR A 373
 None
 1.43A 5mm4B-3evrA:
undetectable		 5mm4B-3evrA:
10.47
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.
3faw RETICULOCYTE BINDING
PROTEIN

(Streptococcus
agalactiae) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 GLU A 967
LEU A 717
ALA A 618
SER A 964
THR A 639
 None
 1.34A 5mm4B-3fawA:
undetectable		 5mm4B-3fawA:
6.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iqd OCTOPINE
DEHYDROGENASE

(Pecten maximus) 		PF02317
(Octopine_DH) 		5 VAL B   5
LEU B 144
ALA B  21
PRO B  69
LEU B  51
 None
NAI  B 405 (-3.9A)
None
None
None
 1.42A 5mm4B-3iqdB:
undetectable		 5mm4B-3iqdB:
12.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jsa HOMOSERINE
DEHYDROGENASE

(Thermoplasma
volcanium) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		5 LEU A 320
ALA A  41
SER A  46
PHE A   9
LEU A  80
 None
NAD  A 501 (-3.8A)
None
None
None
 1.38A 5mm4B-3jsaA:
undetectable		 5mm4B-3jsaA:
12.58
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.
3kzu 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
SYNTHASE II

(Brucella
melitensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLU A 304
LEU A 248
ALA A 298
THR A 174
LEU A 400
 None
 1.45A 5mm4B-3kzuA:
undetectable		 5mm4B-3kzuA:
10.28
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.
3l42 PEREGRIN

(Homo sapiens) 		PF00855
(PWWP) 		5 GLU A1178
LEU A1130
ALA A1091
PHE A1147
PRO A1097
 None
 1.32A 5mm4B-3l42A:
undetectable		 5mm4B-3l42A:
21.21
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.
3mg0 PROTEASOME COMPONENT
PRE6

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		5 GLU C 211
LEU C  28
ALA C  37
THR C 151
LEU C  76
 None
 1.36A 5mm4B-3mg0C:
undetectable		 5mm4B-3mg0C:
18.14
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.
3ne5 CATION EFFLUX SYSTEM
PROTEIN CUSA

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 VAL A  76
GLU A 112
LEU A 673
ALA A 106
LEU A 129
 None
 1.45A 5mm4B-3ne5A:
undetectable		 5mm4B-3ne5A:
5.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q1n GALACTOSE MUTAROTASE
RELATED ENZYME

(Lactobacillus
paracasei) 		PF01263
(Aldose_epim) 		5 GLU A  31
LEU A 110
ALA A  45
PHE A 141
LEU A 121
 None
 1.35A 5mm4B-3q1nA:
undetectable		 5mm4B-3q1nA:
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.
3r9b CYTOCHROME P450
164A2

(Mycolicibacterium
smegmatis) 		PF00067
(p450) 		5 GLU A 294
LEU A 136
ALA A 289
THR A 129
LEU A 374
 None
 1.36A 5mm4B-3r9bA:
undetectable		 5mm4B-3r9bA:
11.11
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.
3rd8 FUMARATE HYDRATASE
CLASS II

(Mycolicibacterium
smegmatis) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 GLU A 264
LEU A  52
ALA A 223
THR A 104
LEU A 356
 None
 1.34A 5mm4B-3rd8A:
undetectable		 5mm4B-3rd8A:
9.82
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.
3rg1 CD180 MOLECULE

(Bos taurus) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		5 VAL A 434
LEU A 471
ALA A 415
PHE A 416
LEU A 403
 None
 1.24A 5mm4B-3rg1A:
undetectable		 5mm4B-3rg1A:
9.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3shw TIGHT JUNCTION
PROTEIN ZO-1

(Homo sapiens) 		PF00595
(PDZ)
PF00625
(Guanylate_kin)
PF07653
(SH3_2) 		5 VAL A 450
ALA A 456
SER A 454
PHE A 427
LEU A 487
 None
 1.11A 5mm4B-3shwA:
undetectable		 5mm4B-3shwA:
11.30
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.
3tma METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 LEU A 176
ALA A 284
THR A 298
PRO A 309
LEU A 308
 None
 1.28A 5mm4B-3tmaA:
2.8		 5mm4B-3tmaA:
11.62
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.
3uyk NDP-RHAMNOSYLTRANSFE
RASE

(Saccharopolyspora
spinosa) 		PF06722
(DUF1205) 		5 VAL A 250
LEU A 279
ALA A 244
PRO A 268
LEU A 267
 None
 1.08A 5mm4B-3uykA:
4.4		 5mm4B-3uykA:
12.53
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.
3wdj TYPE I PULLULANASE

(Anoxybacillus
sp. LM18-11) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 VAL A  87
LEU A  73
ALA A  13
THR A  19
LEU A  49
 None
 1.28A 5mm4B-3wdjA:
undetectable		 5mm4B-3wdjA:
7.72
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.
3wnp CYCLOISOMALTOOLIGOSA
CCHARIDE
GLUCANOTRANSFERASE

(Bacillus
circulans) 		PF13199
(Glyco_hydro_66)
PF16990
(CBM_35) 		5 HIS A 224
ALA A 230
PHE A 302
THR A 299
LEU A 216
 None
 1.34A 5mm4B-3wnpA:
undetectable		 5mm4B-3wnpA:
8.78
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.
4a9a RIBOSOME-INTERACTING
GTPASE 1

(Saccharomyces
cerevisiae) 		PF01926
(MMR_HSR1)
PF02824
(TGS)
PF16897
(MMR_HSR1_Xtn) 		5 VAL A 286
GLU A 282
LEU A 166
PRO A 271
LEU A 249
 None
 1.34A 5mm4B-4a9aA:
undetectable		 5mm4B-4a9aA:
11.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4apb FUMARATE HYDRATASE
CLASS II

(Mycobacterium
tuberculosis) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 GLU A 266
LEU A  54
ALA A 225
THR A 106
LEU A 358
 None
 1.34A 5mm4B-4apbA:
undetectable		 5mm4B-4apbA:
11.28
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.
4fzh HEMAGGLUTININ-NEURAM
INIDASE

(Avian
avulavirus 1) 		PF00423
(HN) 		5 VAL A 469
GLU A 401
LEU A 608
ALA A 525
PHE A 556
 None
 1.36A 5mm4B-4fzhA:
undetectable		 5mm4B-4fzhA:
9.89
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.
4g38 SULFITE REDUCTASE
[NADPH] HEMOPROTEIN
BETA-COMPONENT

(Escherichia
coli) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 LEU A 398
ALA A 103
PHE A 122
THR A 119
LEU A 137
 None
None
None
SRM  A 604 (-4.2A)
None
 1.08A 5mm4B-4g38A:
undetectable		 5mm4B-4g38A:
8.21
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.
4hjl NAPHTHALENE
1,2-DIOXYGENASE
SUBUNIT ALPHA
NAPHTHALENE
1,2-DIOXYGENASE
SUBUNIT BETA

(Pseudomonas sp.
C18) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A)
PF00866
(Ring_hydroxyl_B) 		5 VAL A  55
GLU B  69
LEU A 159
ALA A  57
PRO A 186
 None
EDO  A 507 (-3.7A)
None
None
EDO  A 507 (-4.3A)
 1.24A 5mm4B-4hjlA:
undetectable		 5mm4B-4hjlA:
12.43
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.
4hvl MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
thermoresistibile) 		PF00082
(Peptidase_S8) 		5 VAL A  90
LEU A 321
ALA A 338
SER A 341
THR A 309
 None
 1.17A 5mm4B-4hvlA:
undetectable		 5mm4B-4hvlA:
12.40
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.
4n0i GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF01425
(Amidase) 		5 VAL A 138
LEU A 206
ALA A 134
THR A 188
PRO A 158
 None
 1.34A 5mm4B-4n0iA:
undetectable		 5mm4B-4n0iA:
11.21
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.
4n4w CYTOCHROME
B(562),SMOOTHENED
HOMOLOG

(Homo sapiens;
Shigella
flexneri) 		PF01534
(Frizzled)
PF07361
(Cytochrom_B562) 		5 LEU A  14
ALA A  40
PHE A  65
THR A  97
PRO A  45
 None
 1.44A 5mm4B-4n4wA:
undetectable		 5mm4B-4n4wA:
10.45
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.
4oe1 CHLOROPLAST
PENTATRICOPEPTIDE
REPEAT PROTEIN 10

(Zea mays) 		PF01535
(PPR)
PF12854
(PPR_1)
PF13041
(PPR_2)
PF13812
(PPR_3) 		5 HIS A 276
ALA A 248
SER A 249
PHE A 267
LEU A 233
 None
None
A  C   3 ( 2.6A)
None
None
 1.43A 5mm4B-4oe1A:
undetectable		 5mm4B-4oe1A:
8.07
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.
4u60 STRUCTURAL PROTEIN
VP1

(Human
polyomavirus 8) 		PF00718
(Polyoma_coat) 		5 VAL A 211
GLU A 212
LEU A 240
PHE A 275
THR A 236
 None
 1.37A 5mm4B-4u60A:
undetectable		 5mm4B-4u60A:
12.55
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.
4uaq PROTEIN TRANSLOCASE
SUBUNIT SECA 2

(Mycobacterium
tuberculosis) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		5 GLU A 414
LEU A 458
HIS A 434
THR A 494
LEU A 525
 None
 1.36A 5mm4B-4uaqA:
undetectable		 5mm4B-4uaqA:
6.72
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.
4uaq PROTEIN TRANSLOCASE
SUBUNIT SECA 2

(Mycobacterium
tuberculosis) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		5 GLU A 414
LEU A 462
HIS A 434
THR A 494
LEU A 525
 None
 1.45A 5mm4B-4uaqA:
undetectable		 5mm4B-4uaqA:
6.72
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.
4yzk TRYPTOPHAN
DIMETHYLALLYLTRANSFE
RASE

(Streptomyces
blastmyceticus) 		PF11991
(Trp_DMAT) 		5 LEU A 282
HIS A 273
ALA A 270
PHE A 303
LEU A 224
 None
 1.37A 5mm4B-4yzkA:
undetectable		 5mm4B-4yzkA:
11.20
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.
4zwv PUTATIVE
AMINOTRANSFERASE

(Actinomadura
melliaura) 		PF01041
(DegT_DnrJ_EryC1) 		5 LEU A  58
HIS A 127
ALA A 162
SER A 289
LEU A  43
 None
 1.45A 5mm4B-4zwvA:
undetectable		 5mm4B-4zwvA:
12.43
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.
5a2o NITRATE TRANSPORTER
1.1

(Arabidopsis
thaliana) 		PF00854
(PTR2) 		5 VAL A 518
GLU A 522
LEU A 465
ALA A  71
THR A 369
 None
 1.30A 5mm4B-5a2oA:
undetectable		 5mm4B-5a2oA:
8.15
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.
5a6b N-ACETYL-BETA-D-GLUC
OSAMINIDASE

(Streptococcus
pneumoniae) 		PF00728
(Glyco_hydro_20) 		5 LEU D 120
ALA D 336
SER D 349
PRO D 387
LEU D 386
 None
 1.38A 5mm4B-5a6bD:
undetectable		 5mm4B-5a6bD:
8.02
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.
5aw4 NA, K-ATPASE ALPHA
SUBUNIT

(Squalus
acanthias) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 ALA A 271
SER A 275
PHE A 161
THR A 247
PRO A 723
 None
 1.42A 5mm4B-5aw4A:
2.7		 5mm4B-5aw4A:
5.98
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.
5ci5 EXTRACELLULAR
SOLUTE-BINDING
PROTEIN FAMILY 1

(Pseudothermotoga
lettingae) 		PF13416
(SBP_bac_8) 		5 VAL A 329
LEU A 295
SER A 346
PHE A 358
THR A 360
 None
 1.28A 5mm4B-5ci5A:
undetectable		 5mm4B-5ci5A:
12.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f6z SANDERCYANIN
FLUORESCENT PROTEIN

(Sander vitreus) 		PF08212
(Lipocalin_2) 		5 VAL A 169
LEU A 152
ALA A 143
THR A 121
PRO A  30
 None
 1.20A 5mm4B-5f6zA:
undetectable		 5mm4B-5f6zA:
17.76
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.
5gui CHAPERONE PROTEIN
CLPC1, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF02861
(Clp_N) 		5 VAL A 231
LEU A 181
ALA A 138
THR A 123
LEU A 217
 None
None
None
PO4  A 302 (-3.0A)
None
 1.37A 5mm4B-5guiA:
undetectable		 5mm4B-5guiA:
18.30
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.
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom)
PF11865
(DUF3385) 		5 GLU A2196
LEU A1956
THR A1962
PRO A1975
LEU A1976
 None
 1.18A 5mm4B-5h64A:
undetectable		 5mm4B-5h64A:
2.84
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.
5hon EXTRACELLULAR
ARABINANASE

(Geobacillus
stearothermophilus) 		PF13385
(Laminin_G_3) 		5 VAL A 802
LEU A 828
ALA A 731
PHE A 729
THR A 727
 None
 1.44A 5mm4B-5honA:
undetectable		 5mm4B-5honA:
17.22
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.
5hp6 EXTRACELLULAR
ARABINANASE

(Geobacillus
stearothermophilus) 		PF04616
(Glyco_hydro_43)
PF13385
(Laminin_G_3)
PF16369
(GH43_C) 		5 VAL A 802
LEU A 828
ALA A 731
PHE A 729
THR A 727
 None
 1.42A 5mm4B-5hp6A:
undetectable		 5mm4B-5hp6A:
7.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hy4 RING-OPENING
AMIDOHYDROLASE

(Frankia sp.
Eul1b) 		PF09663
(Amido_AtzD_TrzD) 		5 LEU A  77
ALA A  18
SER A 272
THR A  93
LEU A 264
 None
 1.27A 5mm4B-5hy4A:
undetectable		 5mm4B-5hy4A:
9.05
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.
5ik8 LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1)
PF02210
(Laminin_G_2) 		5 LEU A2783
ALA A2771
SER A2923
THR A2811
PRO A2887
 None
 1.29A 5mm4B-5ik8A:
undetectable		 5mm4B-5ik8A:
11.20
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.
5ik8 LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1)
PF02210
(Laminin_G_2) 		5 LEU A2783
SER A2923
THR A2811
PRO A2887
LEU A2886
 None
 1.23A 5mm4B-5ik8A:
undetectable		 5mm4B-5ik8A:
11.20
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.
5ik8 LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1)
PF02210
(Laminin_G_2) 		5 LEU A2875
SER A2923
THR A2811
PRO A2887
LEU A2886
 None
 1.08A 5mm4B-5ik8A:
undetectable		 5mm4B-5ik8A:
11.20
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.
5jjq AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Streptomyces
sp. ML694-90F3) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 VAL A 320
LEU A  86
SER A 374
THR A  22
LEU A 196
 None
 1.17A 5mm4B-5jjqA:
undetectable		 5mm4B-5jjqA:
10.08
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.
5l2p ARYLESTERASE

(Sulfolobus
solfataricus) 		PF07859
(Abhydrolase_3) 		5 LEU A  62
HIS A  82
ALA A 157
SER A 156
THR A 124
 None
 1.28A 5mm4B-5l2pA:
undetectable		 5mm4B-5l2pA:
15.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 6 VAL B  23
GLU B  27
ALA B 233
PHE B 272
PRO B 360
LEU B 371
 None
 0.83A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 6 VAL B  23
GLU B  27
ALA B 233
PHE B 272
THR B 276
LEU B 371
 None
 1.08A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 6 VAL B  23
GLU B  27
HIS B 229
ALA B 233
PHE B 272
PRO B 360
 None
 0.75A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 6 VAL B  23
GLU B  27
HIS B 229
ALA B 233
PHE B 272
THR B 276
 None
 0.95A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 6 VAL B  23
GLU B  27
LEU B 219
ALA B 233
PRO B 360
LEU B 371
 None
 0.93A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 6 VAL B  23
GLU B  27
LEU B 219
HIS B 229
ALA B 233
PRO B 360
 None
 0.90A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 5 VAL B  23
HIS B 229
SER B 236
PHE B 272
PRO B 360
 None
 0.84A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 5 VAL B  23
HIS B 229
SER B 236
PHE B 272
THR B 276
 None
 1.01A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 5 VAL B  23
SER B 236
PHE B 272
PRO B 360
LEU B 371
 None
 0.88A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 5 VAL B  23
SER B 236
PHE B 272
THR B 276
LEU B 371
 None
 1.11A 5mm4B-5n5nB:
57.8		 5mm4B-5n5nB:
93.75
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.
5w3j TUBULIN BETA CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		6 VAL B  23
LEU B 217
SER B 234
THR B 274
PRO B 358
LEU B 361
 TA1  B 502 (-3.9A)
None
TA1  B 502 ( 4.9A)
TA1  B 502 (-4.7A)
None
TA1  B 502 (-3.7A)
 1.11A 5mm4B-5w3jB:
57.7		 5mm4B-5w3jB:
17.05
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.
5xbp 3NT OXYGENASE ALPHA
SUBUNIT
3NT OXYGENASE BETA
SUBUNIT

(Diaphorobacter
sp. DS2) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A)
PF00866
(Ring_hydroxyl_B) 		5 VAL A  53
GLU C  69
LEU A 157
ALA A  55
PRO A 184
 None
 1.29A 5mm4B-5xbpA:
undetectable		 5mm4B-5xbpA:
12.66
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.
5xmb PANTOTHENATE KINASE

(Mycobacterium
tuberculosis) 		no annotation 5 ALA A 172
PHE A 161
THR A 128
PRO A 195
LEU A 198
 None
 1.33A 5mm4B-5xmbA:
2.0		 5mm4B-5xmbA:
21.84
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.
5xst POLY [ADP-RIBOSE]
POLYMERASE 1

(Homo sapiens) 		no annotation 5 VAL A 143
LEU A 170
ALA A 150
SER A 147
THR A 160
 None
 1.43A 5mm4B-5xstA:
undetectable		 5mm4B-5xstA:
19.32
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.
5za2 BETA-LACTAMASE

(Escherichia
coli) 		no annotation 5 LEU A 117
ALA A 162
SER A 165
THR A 111
LEU A  85
 None
 1.43A 5mm4B-5za2A:
undetectable		 5mm4B-5za2A:
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.
6b6l GLYCOSYL HYDROLASE
FAMILY 2, SUGAR
BINDING DOMAIN
PROTEIN

(Bacteroides
cellulosilyticus) 		no annotation 5 GLU A 691
LEU A 639
HIS A 665
ALA A 687
THR A 683
 None
 1.43A 5mm4B-6b6lA:
undetectable		 5mm4B-6b6lA:
7.93
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.
6dft -

(-) 		no annotation 5 LEU B 268
SER B  77
PHE B  83
PRO B 322
LEU B 325
 None
 1.33A 5mm4B-6dftB:
3.9		 5mm4B-6dftB:
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.
6eot DIPEPTIDYL PEPTIDASE
8

(Homo sapiens) 		no annotation 5 GLU A 726
LEU A 884
ALA A 764
PHE A 772
THR A 664
 None
 1.19A 5mm4B-6eotA:
2.7		 5mm4B-6eotA:
22.99