SIMILAR PATTERNS OF AMINO ACIDS FOR 3T7S_C_SAMC300

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.
1gm5 RECG

(Thermotoga
maritima) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF17190
(RecG_N)
PF17191
(RecG_wedge) 		5 GLY A 682
GLY A 685
GLU A 553
ALA A 688
TYR A 689
 None
 1.26A 3t7sC-1gm5A:
undetectable		 3t7sC-1gm5A:
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.
1kv9 TYPE II
QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Pseudomonas
putida) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		5 GLY A 229
GLY A 227
SER A 270
ALA A 172
ASN A 250
 None
None
None
PQQ  A 801 (-3.0A)
CA  A 802 ( 2.9A)
 1.40A 3t7sC-1kv9A:
undetectable		 3t7sC-1kv9A:
16.62
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.
1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE

(Pseudomonas
fluorescens) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A  37
GLY A  40
GLU A 118
ALA A  43
ASN A  50
 None
 1.32A 3t7sC-1lpfA:
2.2		 3t7sC-1lpfA:
21.76
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.
1m32 2-AMINOETHYLPHOSPHON
ATE-PYRUVATE
AMINOTRANSFERASE

(Salmonella
enterica) 		PF00266
(Aminotran_5) 		5 GLY A  65
GLY A  63
MET A 169
GLU A  70
ALA A  68
 PLP  A4401 (-3.6A)
None
PLP  A4401 (-4.6A)
None
None
 1.25A 3t7sC-1m32A:
3.6		 3t7sC-1m32A:
22.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mpo MALTOPORIN

(Escherichia
coli) 		PF02264
(LamB) 		5 GLN A 233
GLY A 243
GLN A 293
SER A 247
ALA A 235
 None
 1.32A 3t7sC-1mpoA:
undetectable		 3t7sC-1mpoA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o1z GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Thermotoga
maritima) 		PF03009
(GDPD) 		5 GLY A   8
GLY A   5
GLU A  15
ALA A  20
TYR A  13
 None
 1.45A 3t7sC-1o1zA:
undetectable		 3t7sC-1o1zA:
24.92
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.
1oxx ABC TRANSPORTER, ATP
BINDING PROTEIN

(Sulfolobus
solfataricus) 		PF00005
(ABC_tran) 		5 GLY K  35
GLY K 212
SER K 198
GLU K  32
ALA K 208
 None
 0.77A 3t7sC-1oxxK:
undetectable		 3t7sC-1oxxK:
22.97
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.
1s6r BETA-LACTAMASE

(Enterobacter
cloacae) 		PF00144
(Beta-lactamase) 		5 ARG A 177
GLY A  75
MET A 106
GLU A  82
ALA A 162
 None
 1.33A 3t7sC-1s6rA:
undetectable		 3t7sC-1s6rA:
20.70
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.
1u0o VON WILLEBRAND
FACTOR

(Mus musculus) 		PF00092
(VWA) 		5 GLN C 590
GLY C 521
GLY C 588
SER C 562
ALA C 592
 None
 1.37A 3t7sC-1u0oC:
undetectable		 3t7sC-1u0oC:
21.97
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.
1wl7 ARABINANASE-TS

(Geobacillus
thermodenitrificans) 		PF04616
(Glyco_hydro_43) 		5 GLY A 268
GLY A 262
SER A 217
ALA A 287
ASN A 285
 None
 1.17A 3t7sC-1wl7A:
undetectable		 3t7sC-1wl7A:
22.56
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.
1xtp LMAJ004091AAA

(Leishmania
major) 		PF05891
(Methyltransf_PK) 		5 ARG A 106
GLY A 101
GLY A 103
MET A 149
TYR A 170
 SAI  A 401 (-3.9A)
SAI  A 401 (-3.4A)
SAI  A 401 (-3.2A)
SAI  A 401 (-4.4A)
SAI  A 401 (-3.8A)
 1.14A 3t7sC-1xtpA:
15.5		 3t7sC-1xtpA:
21.45
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.
1xtp LMAJ004091AAA

(Leishmania
major) 		PF05891
(Methyltransf_PK) 		5 ARG A 106
GLY A 101
GLY A 103
SER A 148
MET A 149
 SAI  A 401 (-3.9A)
SAI  A 401 (-3.4A)
SAI  A 401 (-3.2A)
SAI  A 401 (-4.0A)
SAI  A 401 (-4.4A)
 1.01A 3t7sC-1xtpA:
15.5		 3t7sC-1xtpA:
21.45
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.
1xvi PUTATIVE
MANNOSYL-3-PHOSPHOGL
YCERATE PHOSPHATASE

(Escherichia
coli) 		PF08282
(Hydrolase_3) 		5 GLN A 171
GLY A  73
GLY A 187
SER A  47
ALA A  74
 None
 1.23A 3t7sC-1xviA:
undetectable		 3t7sC-1xviA:
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.
1yiq QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Pseudomonas
putida) 		PF01011
(PQQ)
PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		5 GLY A 234
GLY A 232
SER A 275
ALA A 177
ASN A 255
 None
None
None
PQQ  A 801 (-2.9A)
CA  A 802 ( 3.0A)
 1.38A 3t7sC-1yiqA:
undetectable		 3t7sC-1yiqA:
15.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yzf LIPASE/ACYLHYDROLASE

(Enterococcus
faecalis) 		PF13472
(Lipase_GDSL_2) 		5 ARG A  92
GLY A 139
GLU A 137
ALA A 140
ASN A 143
 None
 1.25A 3t7sC-1yzfA:
2.9		 3t7sC-1yzfA:
23.46
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.
1zxn DNA TOPOISOMERASE
II, ALPHA ISOZYME

(Homo sapiens) 		PF00204
(DNA_gyraseB)
PF02518
(HATPase_c) 		5 ARG A 242
SER A 103
MET A 102
ALA A  92
ASN A 120
 None
None
None
ADP  A 901 ( 4.8A)
ADP  A 901 (-3.1A)
 1.42A 3t7sC-1zxnA:
undetectable		 3t7sC-1zxnA:
21.59
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.
2cve HYPOTHETICAL PROTEIN
TTHA1053

(Thermus
thermophilus) 		PF01205
(UPF0029)
PF09186
(DUF1949) 		5 GLY A 103
GLY A 100
GLN A  16
ALA A 107
TYR A 108
 None
TLA  A 192 (-3.5A)
None
None
None
 1.39A 3t7sC-2cveA:
undetectable		 3t7sC-2cveA:
19.41
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.
2cwf DELTA1-PIPERIDEINE-2
-CARBOXYLATE
REDUCTASE

(Pseudomonas
syringae group
genomosp. 3) 		PF02615
(Ldh_2) 		5 ARG A  88
GLY A 275
GLY A 255
SER A 150
ALA A 249
 None
None
None
NDP  A2510 (-4.2A)
None
 1.45A 3t7sC-2cwfA:
undetectable		 3t7sC-2cwfA:
21.39
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.
2d1f THREONINE SYNTHASE

(Mycobacterium
tuberculosis) 		PF00291
(PALP) 		5 GLY A  72
GLU A 171
ALA A 203
TYR A 204
ASN A 200
 None
None
None
None
PLP  A 500 (-4.9A)
 1.28A 3t7sC-2d1fA:
undetectable		 3t7sC-2d1fA:
24.00
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.
2dkh 3-HYDROXYBENZOATE
HYDROXYLASE

(Comamonas
testosteroni) 		PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim) 		5 GLN A 367
GLY A 446
GLY A 444
GLN A 360
TYR A 449
 None
 1.24A 3t7sC-2dkhA:
undetectable		 3t7sC-2dkhA:
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.
2gp6 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 173
GLY A 349
SER A 110
GLU A 355
ALA A 174
 None
 1.15A 3t7sC-2gp6A:
undetectable		 3t7sC-2gp6A:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ior CHAPERONE PROTEIN
HTPG

(Escherichia
coli) 		PF02518
(HATPase_c) 		5 ARG A 142
GLY A  82
GLY A  84
SER A  40
GLU A  58
 None
None
ADP  A1000 ( 4.4A)
None
None
 1.16A 3t7sC-2iorA:
undetectable		 3t7sC-2iorA:
22.22
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.
2ix4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Arabidopsis
thaliana) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 212
GLY A 392
SER A 149
GLU A 398
ALA A 213
 None
6NA  A1462 ( 4.3A)
None
K  A1463 (-3.7A)
None
 1.21A 3t7sC-2ix4A:
undetectable		 3t7sC-2ix4A:
19.35
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.
2jbr P-HYDROXYPHENYLACETA
TE HYDROXYLASE C2
OXYGENASE COMPONENT

(Acinetobacter
baumannii) 		PF02771
(Acyl-CoA_dh_N)
PF08028
(Acyl-CoA_dh_2) 		5 GLY A 276
GLY A 105
SER A 271
GLU A 283
ALA A 278
 None
 1.39A 3t7sC-2jbrA:
undetectable		 3t7sC-2jbrA:
19.52
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.
2o7q BIFUNCTIONAL
3-DEHYDROQUINATE
DEHYDRATASE/SHIKIMAT
E DEHYDROGENASE

(Arabidopsis
thaliana) 		PF01487
(DHquinase_I)
PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		5 ARG A 488
GLY A 465
GLY A 460
GLU A 386
ALA A 464
 None
None
None
SO4  A1401 (-3.8A)
None
 1.31A 3t7sC-2o7qA:
undetectable		 3t7sC-2o7qA:
18.87
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.
2okk GLUTAMATE
DECARBOXYLASE 2

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		5 GLN A 500
GLY A 337
GLY A 342
SER A 281
ALA A 336
 None
None
None
GOL  A 587 (-3.9A)
None
 1.37A 3t7sC-2okkA:
undetectable		 3t7sC-2okkA:
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.
2pl3 PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX10

(Homo sapiens) 		PF00270
(DEAD) 		5 ARG A 162
GLY A  83
GLY A 165
ALA A  87
TYR A  89
 None
None
None
None
ADP  A 300 (-4.6A)
 1.28A 3t7sC-2pl3A:
3.1		 3t7sC-2pl3A:
22.61
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.
2rkb SERINE
DEHYDRATASE-LIKE

(Homo sapiens) 		PF00291
(PALP) 		5 ARG A 105
GLY A  76
GLY A  73
GLU A 109
ALA A  78
 None
 1.34A 3t7sC-2rkbA:
2.5		 3t7sC-2rkbA:
21.39
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.
2uu7 GLUTAMINE SYNTHETASE

(Canis lupus) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		5 GLY A 251
GLY A 249
GLN A 201
ALA A 344
ASN A 345
 None
 1.45A 3t7sC-2uu7A:
undetectable		 3t7sC-2uu7A:
22.67
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.
2vut NITROGEN METABOLITE
REPRESSION REGULATOR
NMRA

(Aspergillus
nidulans) 		PF05368
(NmrA) 		5 ARG A  23
GLY A 197
GLU A 193
ALA A 192
TYR A 153
 None
None
None
None
NAD  A1353 (-3.5A)
 1.41A 3t7sC-2vutA:
5.0		 3t7sC-2vutA:
22.71
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.
2x27 OUTER MEMBRANE
PROTEIN OPRG

(Pseudomonas
aeruginosa) 		PF03922
(OmpW) 		5 GLN X 100
GLY X 154
GLY X 115
ALA X 168
ASN X 166
 None
None
C8E  X1227 (-3.5A)
None
None
 1.12A 3t7sC-2x27X:
undetectable		 3t7sC-2x27X:
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.
2x40 BETA-GLUCOSIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 GLY A 332
SER A  89
MET A  86
GLU A 524
ALA A 521
 None
 1.07A 3t7sC-2x40A:
undetectable		 3t7sC-2x40A:
16.42
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.
2y4l MANNOSYLGLYCERATE
SYNTHASE

(Rhodothermus
marinus) 		no annotation 5 GLN A 247
GLY A 203
GLY A 246
GLU A 155
ALA A 249
 None
 1.15A 3t7sC-2y4lA:
2.3		 3t7sC-2y4lA:
20.31
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.
2z02 PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE

(Methanocaldococcus
jannaschii) 		PF01259
(SAICAR_synt) 		5 GLY A  53
GLY A  51
GLU A  33
ALA A  57
TYR A  79
 None
 1.37A 3t7sC-2z02A:
undetectable		 3t7sC-2z02A:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zc7 BETA-LACTAMASE ACT-1

(Klebsiella
pneumoniae) 		PF00144
(Beta-lactamase) 		5 ARG A 177
GLY A  75
MET A 106
GLU A  82
ALA A 162
 None
 1.35A 3t7sC-2zc7A:
undetectable		 3t7sC-2zc7A:
19.61
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.
3bmw CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 ARG A 587
GLY A 238
GLN A 204
SER A 277
TYR A 187
 None
GOL  A 706 (-3.8A)
None
None
GOL  A 706 (-4.1A)
 1.38A 3t7sC-3bmwA:
undetectable		 3t7sC-3bmwA:
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.
3d31 SULFATE/MOLYBDATE
ABC TRANSPORTER,
ATP-BINDING PROTEIN

(Methanosarcina
acetivorans) 		PF00005
(ABC_tran)
PF03459
(TOBE) 		5 ARG A 348
GLY A 244
GLY A 259
GLU A 262
ALA A 241
 None
 1.26A 3t7sC-3d31A:
undetectable		 3t7sC-3d31A:
22.89
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.
3err FUSION PROTEIN OF
MICROTUBULE BINDING
DOMAIN FROM MOUSE
CYTOPLASMIC DYNEIN
AND SERYL-TRNA
SYNTHETASE FROM
THERMUS THERMOPHILUS

(Thermus
thermophilus;
Mus musculus) 		PF00587
(tRNA-synt_2b)
PF12777
(MT) 		5 GLN A 330
GLY A 321
GLY A 324
ALA A 319
ASN A 117
 None
 1.15A 3t7sC-3errA:
undetectable		 3t7sC-3errA:
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.
3err FUSION PROTEIN OF
MICROTUBULE BINDING
DOMAIN FROM MOUSE
CYTOPLASMIC DYNEIN
AND SERYL-TRNA
SYNTHETASE FROM
THERMUS THERMOPHILUS

(Thermus
thermophilus;
Mus musculus) 		PF00587
(tRNA-synt_2b)
PF12777
(MT) 		5 GLY A 321
GLY A 324
GLU A  20
ALA A 319
ASN A 117
 None
 1.20A 3t7sC-3errA:
undetectable		 3t7sC-3errA:
17.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3f4k PUTATIVE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF13649
(Methyltransf_25) 		5 GLY A  54
GLN A  60
MET A 105
GLU A 121
ASN A 126
 None
 1.32A 3t7sC-3f4kA:
36.4		 3t7sC-3f4kA:
57.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3f4k PUTATIVE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF13649
(Methyltransf_25) 		5 GLY A  54
GLY A  56
GLN A  60
MET A 105
GLU A 121
 None
 0.36A 3t7sC-3f4kA:
36.4		 3t7sC-3f4kA:
57.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3f4k PUTATIVE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF13649
(Methyltransf_25) 		5 GLY A  54
GLY A  56
GLN A  60
SER A 104
GLU A 121
 None
 0.82A 3t7sC-3f4kA:
36.4		 3t7sC-3f4kA:
57.46
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.
3hrd NICOTINATE
DEHYDROGENASE SMALL
FES SUBUNIT

(Eubacterium
barkeri) 		PF00111
(Fer2)
PF01799
(Fer2_2) 		5 ARG D  24
GLY D  45
GLU D  40
ALA D  49
ASN D 134
 None
FES  D 908 ( 3.2A)
None
None
None
 1.19A 3t7sC-3hrdD:
undetectable		 3t7sC-3hrdD:
21.51
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.
3i07 ORGANIC
HYDROPEROXIDE
RESISTANCE PROTEIN

(Vibrio cholerae) 		PF02566
(OsmC) 		5 ARG A  20
GLY A  89
GLU A  51
ALA A  97
ASN A  91
 None
 1.35A 3t7sC-3i07A:
undetectable		 3t7sC-3i07A:
19.26
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.
3i3w PHOSPHOGLUCOSAMINE
MUTASE

(Francisella
tularensis) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 ARG A 244
GLY A 240
SER A  52
ALA A 100
ASN A 108
 SEP  A 101 ( 4.1A)
SEP  A 101 ( 3.3A)
None
SEP  A 101 ( 3.6A)
None
 1.36A 3t7sC-3i3wA:
undetectable		 3t7sC-3i3wA:
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.
3j0h PHIKZ029

(Pseudomonas
virus phiKZ) 		no annotation 5 GLY A 378
SER A 195
GLU A 159
ALA A 375
ASN A 204
 None
 1.11A 3t7sC-3j0hA:
undetectable		 3t7sC-3j0hA:
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.
3jz4 SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE
[NADP+]

(Escherichia
coli) 		PF00171
(Aldedh) 		5 ARG A 427
GLY A 429
GLU A 399
ALA A 419
ASN A 440
 None
 1.45A 3t7sC-3jz4A:
3.8		 3t7sC-3jz4A:
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.
3kdj PROTEIN PHOSPHATASE
2C 56

(Arabidopsis
thaliana) 		PF00481
(PP2C) 		5 GLN B 183
GLY B 178
GLY B 181
SER B 314
ALA B 185
 None
 1.29A 3t7sC-3kdjB:
undetectable		 3t7sC-3kdjB:
21.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kkz UNCHARACTERIZED
PROTEIN Q5LES9

(Bacteroides
fragilis) 		PF13649
(Methyltransf_25) 		10 ARG A  25
GLY A  54
GLY A  56
GLN A  60
SER A 104
MET A 105
GLU A 121
ALA A 123
TYR A 125
ASN A 126
 SAM  A 301 (-3.7A)
SAM  A 301 (-3.7A)
SAM  A 301 (-3.1A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.1A)
SAM  A 301 (-4.5A)
None
SAM  A 301 ( 3.7A)
None
SAM  A 301 (-3.0A)
 0.29A 3t7sC-3kkzA:
40.0		 3t7sC-3kkzA:
69.03
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.
3l91 ACYL-HOMOSERINE
LACTONE ACYLASE PVDQ
SUBUNIT BETA

(Pseudomonas
aeruginosa) 		PF01804
(Penicil_amidase) 		5 GLN B 656
GLY B 694
GLN B 681
ALA B 679
ASN B 678
 None
 1.45A 3t7sC-3l91B:
undetectable		 3t7sC-3l91B:
19.06
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.
3mc1 PREDICTED
PHOSPHATASE, HAD
FAMILY

(Clostridium
acetobutylicum) 		PF13419
(HAD_2) 		5 GLY A 182
GLY A 164
GLU A 192
ALA A 198
ASN A 199
 None
 0.92A 3t7sC-3mc1A:
undetectable		 3t7sC-3mc1A:
22.46
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.
3nwn KINESIN-LIKE PROTEIN
KIF9

(Homo sapiens) 		PF00225
(Kinesin) 		5 GLY A  93
GLY A 248
SER A 329
ALA A  97
TYR A 318
 None
None
None
ADP  A 401 (-4.6A)
None
 1.16A 3t7sC-3nwnA:
undetectable		 3t7sC-3nwnA:
23.61
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.
3q7p GTP-BINDING PROTEIN
RAD

(Homo sapiens) 		PF00071
(Ras) 		5 GLY A 103
GLY A 101
SER A 233
GLU A 147
ALA A 106
 GNP  A 256 (-3.2A)
GNP  A 256 (-3.5A)
GNP  A 256 (-3.6A)
MG  A 257 ( 2.8A)
GNP  A 256 (-3.1A)
 1.44A 3t7sC-3q7pA:
undetectable		 3t7sC-3q7pA:
20.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3t7s PUTATIVE
METHYLTRANSFERASE

(Bacteroides
vulgatus) 		PF13649
(Methyltransf_25) 		11 ARG A  25
GLN A  26
GLY A  54
GLY A  56
GLN A  60
SER A 104
MET A 105
GLU A 121
ALA A 123
TYR A 125
ASN A 126
 SAM  A 300 (-4.0A)
SAM  A 300 (-3.5A)
SAM  A 300 (-3.7A)
SAM  A 300 (-3.4A)
SAM  A 300 (-3.4A)
SAM  A 300 (-2.8A)
SAM  A 300 (-4.1A)
None
SAM  A 300 (-3.6A)
None
SAM  A 300 (-3.1A)
 0.15A 3t7sC-3t7sA:
43.0		 3t7sC-3t7sA:
100.00
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.
3tox SHORT CHAIN
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 ARG A 220
GLY A 191
SER A 144
GLU A 226
ALA A 249
 None
NAP  A 601 (-3.5A)
None
None
None
 1.08A 3t7sC-3toxA:
6.6		 3t7sC-3toxA:
22.80
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.
3ujk PROTEIN PHOSPHATASE
2C 77

(Arabidopsis
thaliana) 		PF00481
(PP2C) 		5 GLN A 171
GLY A 166
GLY A 169
SER A 304
ALA A 173
 None
MG  A 426 (-4.2A)
None
None
None
 1.30A 3t7sC-3ujkA:
undetectable		 3t7sC-3ujkA:
22.69
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.
3vsj 2-AMINO-5-CHLOROPHEN
OL 1,6-DIOXYGENASE
ALPHA SUBUNIT

(Comamonas
testosteroni) 		PF02900
(LigB) 		5 GLY A  35
GLY A 129
SER A  41
GLU A  32
ALA A  34
 None
 1.43A 3t7sC-3vsjA:
2.9		 3t7sC-3vsjA:
22.77
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.
3w95 GENOME POLYPROTEIN

(Enterovirus A) 		PF00947
(Pico_P2A) 		5 ARG A 115
GLY A   8
GLY A 112
GLN A   6
ALA A   9
 None
 1.32A 3t7sC-3w95A:
undetectable		 3t7sC-3w95A:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wq4 BETA-PRIMEVEROSIDASE

(Camellia
sinensis) 		PF00232
(Glyco_hydro_1) 		5 ARG A 118
GLY A  85
SER A  83
GLU A  55
ALA A  88
 None
 1.39A 3t7sC-3wq4A:
undetectable		 3t7sC-3wq4A:
18.87
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.
4b52 BACILLOLYSIN

(Paenibacillus
polymyxa) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 GLY A 217
GLY A 211
GLU A 153
TYR A 151
ASN A 215
 None
 1.40A 3t7sC-4b52A:
undetectable		 3t7sC-4b52A:
20.73
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.
4bkw ZINC FINGER FYVE
DOMAIN-CONTAINING
PROTEIN 9

(Homo sapiens) 		PF11979
(DUF3480) 		5 ARG A1095
GLY A1031
GLN A1060
SER A1021
GLU A1063
 None
 0.86A 3t7sC-4bkwA:
undetectable		 3t7sC-4bkwA:
18.79
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.
4d9i DIAMINOPROPIONATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00291
(PALP) 		5 ARG A  70
GLY A 205
SER A  25
GLU A 212
ALA A 210
 None
 1.45A 3t7sC-4d9iA:
2.5		 3t7sC-4d9iA:
20.77
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.
4dn7 ABC TRANSPORTER,
ATP-BINDING PROTEIN

(Methanosarcina
mazei) 		PF01458
(UPF0051) 		5 GLY A 253
GLY A 255
SER A 223
ALA A 282
ASN A 281
 None
None
1PE  A 500 ( 4.6A)
None
None
 1.45A 3t7sC-4dn7A:
undetectable		 3t7sC-4dn7A:
21.80
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.
4eh1 FLAVOHEMOPROTEIN

(Vibrio cholerae) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 GLN A 174
GLN A 131
SER A 153
GLU A 162
ALA A 160
 None
 1.45A 3t7sC-4eh1A:
2.9		 3t7sC-4eh1A:
21.45
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.
4el8 GLYCOSIDE HYDROLASE
FAMILY 48

(Caldicellulosiruptor
bescii) 		PF02011
(Glyco_hydro_48) 		5 ARG A 613
GLN A 617
GLY A 495
GLU A 546
ALA A 544
 None
 1.34A 3t7sC-4el8A:
undetectable		 3t7sC-4el8A:
19.79
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.
4g2c DYP2

(Amycolatopsis
sp. ATCC 39116) 		no annotation 5 GLN A 393
GLY A 420
GLY A 418
GLN A 445
ALA A 122
 HEM  A 501 (-4.3A)
None
None
None
None
 1.40A 3t7sC-4g2cA:
undetectable		 3t7sC-4g2cA:
18.59
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.
4hxy PLM1

(Streptomyces
sp. HK803) 		PF08659
(KR) 		5 ARG A 103
GLY A 335
GLY A 106
SER A 319
GLU A 299
 None
None
None
NDP  A 501 ( 4.0A)
None
 1.44A 3t7sC-4hxyA:
undetectable		 3t7sC-4hxyA:
17.36
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.
4ktp GLYCOSIDE HYDROLASE
FAMILY 65 CENTRAL
CATALYTIC

([Bacillus]
selenitireducens) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		5 ARG A 358
GLY A 318
GLN A 335
SER A 323
ALA A 319
 None
None
None
None
BGC  A 801 ( 3.7A)
 1.28A 3t7sC-4ktpA:
undetectable		 3t7sC-4ktpA:
16.86
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.
4kvl FATTY ACID
ALPHA-OXIDASE

(Oryza sativa) 		PF03098
(An_peroxidase) 		5 ARG A  85
GLY A 100
GLY A  89
ALA A 211
ASN A 207
 None
 0.82A 3t7sC-4kvlA:
undetectable		 3t7sC-4kvlA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 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) 		5 GLN A 474
GLY A 415
GLY A 419
GLN A 437
TYR A  77
 None
 1.30A 3t7sC-4lxfA:
undetectable		 3t7sC-4lxfA:
16.03
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.
4n2r ALPHA-L-ARABINOFURAN
OSIDASE UMABF62A

(Ustilago maydis) 		PF03664
(Glyco_hydro_62) 		5 GLY A 140
GLY A 138
GLU A 195
ALA A 159
TYR A 165
 None
None
AHR  A 403 (-2.8A)
None
None
 1.18A 3t7sC-4n2rA:
undetectable		 3t7sC-4n2rA:
20.41
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.
4oec GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Thermococcus
kodakarensis) 		PF03009
(GDPD) 		5 GLY A  14
GLY A  11
GLU A  21
ALA A  26
TYR A  19
 None
 1.44A 3t7sC-4oecA:
undetectable		 3t7sC-4oecA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ozq CHIMERA OF
MALTOSE-BINDING
PERIPLASMIC PROTEIN
AND KINESIN FAMILY
MEMBER 14 PROTEIN

(Escherichia
coli;
Mus musculus) 		PF00225
(Kinesin)
PF13416
(SBP_bac_8) 		5 GLN A 678
GLY A 702
GLU A 390
ALA A   0
ASN A  -3
 None
 1.35A 3t7sC-4ozqA:
undetectable		 3t7sC-4ozqA:
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.
4p5h HEAT-LABILE
ENTEROTOXIN B CHAIN

(Clostridium
perfringens) 		PF03505
(Clenterotox) 		5 GLY A  34
GLY A  37
SER A 277
TYR A 264
ASN A 262
 None
 1.37A 3t7sC-4p5hA:
undetectable		 3t7sC-4p5hA:
22.79
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.
4r1d UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A 512
GLN A 183
SER A 504
GLU A 181
ALA A 429
 None
 1.41A 3t7sC-4r1dA:
undetectable		 3t7sC-4r1dA:
17.32
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.
4uhi STEROL 14-ALPHA
DEMETHYLASE

(Homo sapiens) 		PF00067
(p450) 		5 GLY A 303
GLY A 140
GLU A 300
ALA A 302
TYR A 265
 None
 1.30A 3t7sC-4uhiA:
undetectable		 3t7sC-4uhiA:
18.61
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.
4wh3 N-ACETYLHEXOSAMINE
1-KINASE

(Bifidobacterium
longum) 		PF01636
(APH) 		5 ARG A 246
GLN A 333
SER A 260
GLU A 254
ALA A 252
 GOL  A 406 (-4.0A)
None
None
None
None
 1.09A 3t7sC-4wh3A:
undetectable		 3t7sC-4wh3A:
23.97
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.
4wxu MYOCILIN

(Homo sapiens) 		PF02191
(OLF) 		5 GLY A 326
GLN A 337
GLU A 323
TYR A 371
ASN A 428
 NA  A 607 (-3.6A)
None
None
None
CA  A 601 (-3.3A)
 1.43A 3t7sC-4wxuA:
undetectable		 3t7sC-4wxuA:
19.42
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.
4wyr ACETYL-COA
ACETYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ARG A 220
GLY A 342
GLN A 183
ALA A 343
ASN A 316
 None
 1.44A 3t7sC-4wyrA:
undetectable		 3t7sC-4wyrA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xmv AMINOPEPTIDASE N

(Escherichia
coli) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 ARG A 161
GLY A 267
GLY A 159
GLU A 212
ASN A 265
 None
 1.19A 3t7sC-4xmvA:
undetectable		 3t7sC-4xmvA:
14.48
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.
4zhj MG-CHELATASE SUBUNIT
CHLH

(Synechocystis
sp. PCC 6803) 		PF02514
(CobN-Mg_chel)
PF11965
(DUF3479) 		5 GLY A 708
GLN A 740
MET A 716
ALA A 735
ASN A 713
 None
 1.29A 3t7sC-4zhjA:
3.9		 3t7sC-4zhjA:
11.87
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.
5a3f DYNAMIN 3

(Homo sapiens) 		PF00169
(PH)
PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF02212
(GED) 		5 GLN A  40
GLY A  38
GLY A 139
SER A 184
ALA A  42
 None
 1.38A 3t7sC-5a3fA:
undetectable		 3t7sC-5a3fA:
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.
5aa6 VANADIUM-DEPENDENT
BROMOPEROXIDASE 2

(Ascophyllum
nodosum) 		no annotation 5 GLY A 548
SER A 449
ALA A 457
TYR A 458
ASN A 454
 None
VO4  A 800 (-2.7A)
None
None
None
 1.34A 3t7sC-5aa6A:
undetectable		 3t7sC-5aa6A:
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.
5awf FES CLUSTER ASSEMBLY
PROTEIN SUFB

(Escherichia
coli) 		PF01458
(UPF0051) 		5 GLY A 358
GLN A 318
SER A 407
ALA A 347
ASN A 384
 None
 1.44A 3t7sC-5awfA:
undetectable		 3t7sC-5awfA:
21.06
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.
5boe ENOLASE

(Staphylococcus
aureus) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLY A 109
GLY A 106
GLU A  50
ALA A  67
ASN A  70
 None
 1.34A 3t7sC-5boeA:
undetectable		 3t7sC-5boeA:
20.99
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.
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo sapiens) 		PF00117
(GATase)
PF00988
(CPSase_sm_chain)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		5 GLN A 470
GLY A 431
GLY A 429
SER A1352
GLU A 440
 None
 1.36A 3t7sC-5dotA:
undetectable		 3t7sC-5dotA:
11.05
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.
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo sapiens) 		PF00117
(GATase)
PF00988
(CPSase_sm_chain)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		5 GLY A 264
GLY A 266
ALA A  88
TYR A  89
ASN A 336
 None
 1.34A 3t7sC-5dotA:
undetectable		 3t7sC-5dotA:
11.05
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.
5flz TUBULIN GAMMA CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 GLN C  12
GLY C 147
GLY C 145
SER C 171
ALA C  10
 None
 1.34A 3t7sC-5flzC:
undetectable		 3t7sC-5flzC:
18.28
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.
5ho9 EXTRACELLULAR
ARABINANASE

(Geobacillus
stearothermophilus) 		PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		5 GLY A 539
GLY A 366
GLN A 352
SER A 541
ALA A 349
 None
 1.27A 3t7sC-5ho9A:
undetectable		 3t7sC-5ho9A:
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.
5jfc NADH-DEPENDENT
FERREDOXIN:NADP
OXIDOREDUCTASE
SUBUNIT BETA

(Pyrococcus
furiosus) 		PF10418
(DHODB_Fe-S_bind) 		5 GLN S  70
GLY S 115
GLY S 113
SER S 216
ALA S 117
 None
None
None
FAD  S 500 ( 4.7A)
None
 1.43A 3t7sC-5jfcS:
5.3		 3t7sC-5jfcS:
23.93
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.
5jzx UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Mycobacterium
tuberculosis) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		5 GLY A  30
SER A 254
GLU A 337
ALA A 334
ASN A 330
 None
FAD  A 401 (-3.6A)
None
None
None
 1.44A 3t7sC-5jzxA:
undetectable		 3t7sC-5jzxA:
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.
5l56 PLEXIN-A1

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		5 GLY A1222
GLY A1060
GLU A1225
ALA A1221
TYR A1186
 None
 1.24A 3t7sC-5l56A:
undetectable		 3t7sC-5l56A:
11.29
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.
5l9w ACETOPHENONE
CARBOXYLASE DELTA
SUBUNIT

(Aromatoleum
aromaticum) 		PF02538
(Hydantoinase_B) 		5 ARG A 476
GLY A 480
GLY A 582
SER A 418
ALA A 435
 None
 1.20A 3t7sC-5l9wA:
undetectable		 3t7sC-5l9wA:
17.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o8x SOLUBLE LYTIC
TRANSGLYCOSYLASE B

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A 248
SER A 240
MET A 239
GLU A 228
ALA A 230
 None
 1.46A 3t7sC-5o8xA:
undetectable		 3t7sC-5o8xA:
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.
5o9c OSMOPORIN OMP36

(Klebsiella
aerogenes) 		no annotation 5 GLY C 233
GLN C 246
GLU C 269
ALA C 244
TYR C 242
 None
 1.32A 3t7sC-5o9cC:
undetectable		 3t7sC-5o9cC:
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.
5ols RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 GLY A 216
GLY A 218
SER A 245
ALA A 198
ASN A 201
 None
 1.28A 3t7sC-5olsA:
undetectable		 3t7sC-5olsA:
18.11
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.
5ta1 GLYCOSIDE HYDROLASE

(Bacteroides
uniformis) 		no annotation 5 ARG A 560
GLY A 601
GLY A 562
SER A 598
GLU A 298
 None
 1.06A 3t7sC-5ta1A:
undetectable		 3t7sC-5ta1A:
18.56
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.
5zqz TRIFUNCTIONAL ENZYME
SUBUNIT ALPHA,
MITOCHONDRIAL

(Homo sapiens) 		no annotation 5 GLN A 314
GLY A 319
GLY A 311
SER A 324
ALA A 318
 None
 1.36A 3t7sC-5zqzA:
5.8		 3t7sC-5zqzA:
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.
6bi4 DTDP-GLUCOSE
4,6-DEHYDRATASE

(Bacillus
anthracis) 		no annotation 5 GLY A 242
GLY A 243
GLU A 294
ALA A 284
ASN A 240
 None
 1.33A 3t7sC-6bi4A:
6.0		 3t7sC-6bi4A:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6etz BETA-GALACTOSIDASE

(Arthrobacter
sp. 32cB) 		no annotation 5 GLN A 707
GLY A 883
GLY A 898
SER A 921
ALA A 895
 None
 1.28A 3t7sC-6etzA:
undetectable		 3t7sC-6etzA:
undetectable