SIMILAR PATTERNS OF AMINO ACIDS FOR 1C9S_T_TRPT81

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.
1c3x PENTOSYLTRANSFERASE

(Cellulomonas
sp.) 		PF01048
(PNP_UDP_1) 		4 GLY A 118
ALA A  25
THR A 125
THR A  82
 None
 0.71A 1c9sT-1c3xA:
undetectable
1c9sU-1c3xA:
undetectable		 1c9sT-1c3xA:
14.98
1c9sU-1c3xA:
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.
1f26 NITRIC OXIDE
REDUCTASE

(Fusarium
oxysporum) 		PF00067
(p450) 		4 GLY A 344
ALA A 318
HIS A 283
THR A 284
 None
 0.78A 1c9sT-1f26A:
undetectable
1c9sU-1f26A:
undetectable		 1c9sT-1f26A:
11.72
1c9sU-1f26A:
11.72
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.
1i9g HYPOTHETICAL PROTEIN
RV2118C

(Mycobacterium
tuberculosis) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		4 ALA A  60
HIS A  34
THR A  35
SER A  57
 None
 0.91A 1c9sT-1i9gA:
1.2
1c9sU-1i9gA:
1.2		 1c9sT-1i9gA:
15.33
1c9sU-1i9gA:
15.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		5 GLY A 412
ALA A 510
THR A 500
THR A 417
SER A 245
 None
None
None
TRA  A 866 (-4.0A)
TRA  A 866 (-2.6A)
 1.09A 1c9sT-1l5jA:
undetectable
1c9sU-1l5jA:
undetectable		 1c9sT-1l5jA:
7.07
1c9sU-1l5jA:
7.07
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.
1lw3 MYOTUBULARIN-RELATED
PROTEIN 2

(Homo sapiens) 		PF02893
(GRAM)
PF06602
(Myotub-related) 		4 GLY A 420
THR A 428
THR A 424
SER A 271
 PO4  A 655 (-3.6A)
None
None
None
 0.80A 1c9sT-1lw3A:
undetectable
1c9sU-1lw3A:
undetectable		 1c9sT-1lw3A:
7.46
1c9sU-1lw3A:
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.
1mb9 BETA-LACTAM
SYNTHETASE

(Streptomyces
clavuligerus) 		PF00733
(Asn_synthase)
PF13537
(GATase_7) 		4 GLY A  11
THR A 156
THR A 389
SER A 384
 None
 0.87A 1c9sT-1mb9A:
undetectable
1c9sU-1mb9A:
undetectable		 1c9sT-1mb9A:
9.16
1c9sU-1mb9A:
9.16
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.
1mf1 ADENYLOSUCCINATE
SYNTHETASE

(Mus musculus) 		PF00709
(Adenylsucc_synt) 		4 GLY A  66
ALA A 134
HIS A 105
THR A 170
 None
 0.86A 1c9sT-1mf1A:
0.0
1c9sU-1mf1A:
0.0		 1c9sT-1mf1A:
12.81
1c9sU-1mf1A:
12.81
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.
1mio NITROGENASE
MOLYBDENUM IRON
PROTEIN (BETA CHAIN)

(Clostridium
pasteurianum) 		PF00148
(Oxidored_nitro) 		5 GLY B 156
ALA B 151
THR B 139
HIS B 103
THR B 137
 None
 1.27A 1c9sT-1mioB:
undetectable
1c9sU-1mioB:
undetectable		 1c9sT-1mioB:
9.76
1c9sU-1mioB:
9.76
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.
1oh2 SUCROSE SPECIFIC
PORIN

(Salmonella
enterica) 		PF02264
(LamB) 		4 GLY Q 105
ALA Q  96
THR Q  99
THR Q 376
 None
 0.74A 1c9sT-1oh2Q:
undetectable
1c9sU-1oh2Q:
undetectable		 1c9sT-1oh2Q:
12.04
1c9sU-1oh2Q:
12.04
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.
1qh5 PROTEIN
(HYDROXYACYLGLUTATHI
ONE HYDROLASE)

(Homo sapiens) 		PF00753
(Lactamase_B)
PF16123
(HAGH_C) 		4 GLY A  61
ALA A  84
HIS A  55
THR A  52
 None
 0.83A 1c9sT-1qh5A:
undetectable
1c9sU-1qh5A:
undetectable		 1c9sT-1qh5A:
14.90
1c9sU-1qh5A:
14.90
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.
1usc PUTATIVE STYRENE
MONOOXYGENASE SMALL
COMPONENT

(Thermus
thermophilus) 		PF01613
(Flavin_Reduct) 		4 GLY A 113
ALA A 117
HIS A 101
SER A  71
 None
 0.89A 1c9sT-1uscA:
undetectable
1c9sU-1uscA:
undetectable		 1c9sT-1uscA:
21.94
1c9sU-1uscA:
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.
1uzg MAJOR ENVELOPE
PROTEIN E

(Dengue virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		4 THR A 313
HIS A 315
THR A 317
THR A  32
 None
 0.92A 1c9sT-1uzgA:
undetectable
1c9sU-1uzgA:
undetectable		 1c9sT-1uzgA:
11.48
1c9sU-1uzgA:
11.48
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.
1v9c PRECORRIN-8X METHYL
MUTASE

(Thermus
thermophilus) 		PF02570
(CbiC) 		5 GLY A 188
ALA A 196
THR A  49
THR A 183
THR A  40
 None
 1.14A 1c9sT-1v9cA:
undetectable
1c9sU-1v9cA:
undetectable		 1c9sT-1v9cA:
19.25
1c9sU-1v9cA:
19.25
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.
1ybd URIDYLATE KINASE

(Neisseria
meningitidis) 		PF00696
(AA_kinase) 		4 GLY A  23
ALA A 221
THR A  37
THR A  33
 None
 0.89A 1c9sT-1ybdA:
undetectable
1c9sU-1ybdA:
undetectable		 1c9sT-1ybdA:
16.53
1c9sU-1ybdA:
16.53
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.
1zsq MYOTUBULARIN-RELATED
PROTEIN 2

(Homo sapiens) 		PF02893
(GRAM)
PF06602
(Myotub-related) 		4 GLY A 420
THR A 428
THR A 424
SER A 271
 PIB  A3632 (-3.7A)
None
None
None
 0.73A 1c9sT-1zsqA:
undetectable
1c9sU-1zsqA:
undetectable		 1c9sT-1zsqA:
12.02
1c9sU-1zsqA:
12.02
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.
2apo PROBABLE TRNA
PSEUDOURIDINE
SYNTHASE B

(Methanocaldococcus
jannaschii) 		PF01472
(PUA)
PF01509
(TruB_N)
PF08068
(DKCLD)
PF16198
(TruB_C_2) 		4 GLY A 187
ALA A 119
HIS A 116
THR A 192
 None
 0.89A 1c9sT-2apoA:
undetectable
1c9sU-2apoA:
undetectable		 1c9sT-2apoA:
12.32
1c9sU-2apoA:
12.32
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.
2eer NAD-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Sulfurisphaera
tokodaii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLY A 182
ALA A 208
THR A 185
THR A 319
 NAD  A 401 (-3.7A)
NAD  A 401 ( 4.4A)
None
None
 0.80A 1c9sT-2eerA:
undetectable
1c9sU-2eerA:
undetectable		 1c9sT-2eerA:
13.02
1c9sU-2eerA:
13.02
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.
2fff PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		4 GLY B 677
ALA B 688
THR B 417
HIS B 682
 None
None
None
NI  B 901 (-2.8A)
 0.88A 1c9sT-2fffB:
undetectable
1c9sU-2fffB:
undetectable		 1c9sT-2fffB:
11.03
1c9sU-2fffB:
11.03
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.
2iou MAJOR TROPISM
DETERMINANT P1

(Bordetella
virus BPP1) 		no annotation 4 GLY A 373
ALA A 176
HIS A 200
THR A 205
 None
 0.87A 1c9sT-2iouA:
undetectable
1c9sU-2iouA:
undetectable		 1c9sT-2iouA:
12.77
1c9sU-2iouA:
12.77
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.
2nym SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
CATALYTIC SUBUNIT
ALPHA ISOFORM

(Homo sapiens) 		PF00149
(Metallophos) 		4 GLY C  90
ALA C 262
HIS C  63
THR C  96
 None
 0.92A 1c9sT-2nymC:
undetectable
1c9sU-2nymC:
undetectable		 1c9sT-2nymC:
13.83
1c9sU-2nymC:
13.83
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.
2ox1 3-DEHYDROQUINATE
DEHYDRATASE

(Archaeoglobus
fulgidus) 		PF01487
(DHquinase_I) 		4 GLY A 152
ALA A 124
THR A 103
THR A 158
 None
GOL  A 201 ( 4.8A)
None
None
 0.91A 1c9sT-2ox1A:
undetectable
1c9sU-2ox1A:
undetectable		 1c9sT-2ox1A:
15.54
1c9sU-2ox1A:
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.
2qfv ISOCITRATE
DEHYDROGENASE [NADP]

(Saccharomyces
cerevisiae) 		PF00180
(Iso_dh) 		4 GLY A 276
THR A 107
HIS A 134
SER A 198
 None
 0.78A 1c9sT-2qfvA:
0.0
1c9sU-2qfvA:
0.0		 1c9sT-2qfvA:
11.53
1c9sU-2qfvA:
11.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qjt NICOTINAMIDE-NUCLEOT
IDE
ADENYLYLTRANSFERASE

(Francisella
tularensis) 		no annotation 4 GLY B 235
THR B 285
THR B 205
SER B 280
 AMP  B 602 (-3.3A)
None
None
None
 0.90A 1c9sT-2qjtB:
undetectable
1c9sU-2qjtB:
undetectable		 1c9sT-2qjtB:
13.29
1c9sU-2qjtB:
13.29
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.
2wda PUTATIVE SECRETED
LYASE

(Streptomyces
violaceoruber) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		4 GLY A 232
HIS A 244
THR A 245
THR A 191
 PEG  A1779 (-4.4A)
FMT  A1766 (-3.9A)
None
None
 0.85A 1c9sT-2wdaA:
undetectable
1c9sU-2wdaA:
undetectable		 1c9sT-2wdaA:
6.68
1c9sU-2wdaA:
6.68
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.
2xzl ATP-DEPENDENT
HELICASE NAM7

(Saccharomyces
cerevisiae) 		PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		5 GLY A 435
ALA A 407
THR A 442
THR A 439
SER A 402
 ADP  A1854 (-3.1A)
ADP  A1854 ( 4.5A)
None
None
None
 1.24A 1c9sT-2xzlA:
undetectable
1c9sU-2xzlA:
undetectable		 1c9sT-2xzlA:
7.24
1c9sU-2xzlA:
7.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yk0 ERYTHROCYTE MEMBRANE
PROTEIN 1

(Plasmodium
falciparum) 		PF03011
(PFEMP)
PF05424
(Duffy_binding)
PF15447
(NTS) 		4 ALA A  60
HIS A  83
THR A  84
SER A  62
 None
 0.81A 1c9sT-2yk0A:
undetectable
1c9sU-2yk0A:
undetectable		 1c9sT-2yk0A:
6.32
1c9sU-2yk0A:
6.32
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.
2z0m 337AA LONG
HYPOTHETICAL
ATP-DEPENDENT RNA
HELICASE DEAD

(Sulfurisphaera
tokodaii) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		4 GLY A  43
ALA A 190
THR A  18
THR A  24
 None
 0.92A 1c9sT-2z0mA:
undetectable
1c9sU-2z0mA:
undetectable		 1c9sT-2z0mA:
13.55
1c9sU-2z0mA:
13.55
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.
3a1n NDP-SUGAR EPIMERASE

(Thermoplasma
volcanium) 		PF01370
(Epimerase) 		5 GLY A 166
THR A 178
THR A 179
THR A 112
SER A  74
 NAD  A3001 ( 4.6A)
None
NAD  A3001 ( 4.7A)
NAD  A3001 ( 4.5A)
None
 1.34A 1c9sT-3a1nA:
undetectable
1c9sU-3a1nA:
undetectable		 1c9sT-3a1nA:
13.02
1c9sU-3a1nA:
13.02
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.
3aex THREONINE SYNTHASE

(Thermus
thermophilus) 		PF00291
(PALP) 		4 GLY A 187
ALA A 289
THR A 236
THR A  85
 AN7  A1001 (-3.5A)
AN7  A1001 ( 3.9A)
None
AN7  A1001 (-3.7A)
 0.89A 1c9sT-3aexA:
undetectable
1c9sU-3aexA:
undetectable		 1c9sT-3aexA:
11.36
1c9sU-3aexA:
11.36
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.
3afg SUBTILISIN-LIKE
SERINE PROTEASE

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8)
PF04151
(PPC) 		4 GLY A 301
ALA A 292
THR A 358
SER A 251
 None
 0.88A 1c9sT-3afgA:
3.0
1c9sU-3afgA:
3.0		 1c9sT-3afgA:
11.86
1c9sU-3afgA:
11.86
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.
3b4w ALDEHYDE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00171
(Aldedh) 		4 GLY A 417
ALA A 408
THR A 436
SER A 411
 None
 0.89A 1c9sT-3b4wA:
undetectable
1c9sU-3b4wA:
undetectable		 1c9sT-3b4wA:
10.29
1c9sU-3b4wA:
10.29
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.
3cb5 FACT COMPLEX SUBUNIT
SPT16

(Schizosaccharomyces
pombe) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		4 ALA A 187
THR A 426
THR A 414
SER A 191
 None
 0.81A 1c9sT-3cb5A:
undetectable
1c9sU-3cb5A:
undetectable		 1c9sT-3cb5A:
9.95
1c9sU-3cb5A:
9.95
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.
3dbk ELASTASE

(Pseudomonas
aeruginosa) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 GLY A 160
ALA A 165
THR A 147
SER A 167
 None
None
None
ZN  A 302 ( 4.8A)
 0.88A 1c9sT-3dbkA:
undetectable
1c9sU-3dbkA:
undetectable		 1c9sT-3dbkA:
12.75
1c9sU-3dbkA:
12.75
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.
3dh4 SODIUM/GLUCOSE
COTRANSPORTER

(Vibrio
parahaemolyticus) 		PF00474
(SSF) 		4 GLY A  48
ALA A  55
THR A 274
SER A  59
 None
 0.92A 1c9sT-3dh4A:
undetectable
1c9sU-3dh4A:
undetectable		 1c9sT-3dh4A:
10.00
1c9sU-3dh4A:
10.00
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.
3dzc UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Vibrio cholerae) 		PF02350
(Epimerase_2) 		4 GLY A 115
ALA A 119
THR A 143
THR A 100
 None
CL  A 374 ( 4.1A)
None
None
 0.87A 1c9sT-3dzcA:
undetectable
1c9sU-3dzcA:
undetectable		 1c9sT-3dzcA:
11.11
1c9sU-3dzcA:
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.
3eeg 2-ISOPROPYLMALATE
SYNTHASE

(Cytophaga
hutchinsonii) 		PF00682
(HMGL-like) 		5 GLY A 208
ALA A 212
THR A 239
HIS A 204
SER A 214
 None
 1.33A 1c9sT-3eegA:
undetectable
1c9sU-3eegA:
undetectable		 1c9sT-3eegA:
17.23
1c9sU-3eegA:
17.23
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.
3fa3 2,3-DIMETHYLMALATE
LYASE

(Aspergillus
niger) 		PF13714
(PEP_mutase) 		4 GLY A  47
ALA A  72
HIS A  55
THR A  50
 OAF  A 501 (-3.3A)
None
None
None
 0.90A 1c9sT-3fa3A:
undetectable
1c9sU-3fa3A:
undetectable		 1c9sT-3fa3A:
12.25
1c9sU-3fa3A:
12.25
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.
3fao NON-STRUCTURAL
PROTEIN

(Porcine
reproductive
and respiratory
syndrome virus) 		PF05579
(Peptidase_S32) 		4 GLY A 149
ALA A  38
THR A 134
THR A 145
 None
 0.63A 1c9sT-3faoA:
undetectable
1c9sU-3faoA:
undetectable		 1c9sT-3faoA:
18.44
1c9sU-3faoA:
18.44
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.
3fpz THIAZOLE
BIOSYNTHETIC ENZYME

(Saccharomyces
cerevisiae) 		PF01946
(Thi4) 		4 GLY A  77
ALA A 316
THR A 234
SER A 277
 None
 0.77A 1c9sT-3fpzA:
undetectable
1c9sU-3fpzA:
undetectable		 1c9sT-3fpzA:
16.03
1c9sU-3fpzA:
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.
3gve YFKN PROTEIN

(Bacillus
subtilis) 		PF00149
(Metallophos) 		4 ALA A  72
THR A 332
HIS A 329
THR A 328
 None
 0.83A 1c9sT-3gveA:
undetectable
1c9sU-3gveA:
undetectable		 1c9sT-3gveA:
12.61
1c9sU-3gveA:
12.61
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.
3icy SENSOR PROTEIN

(Chlorobaculum
tepidum) 		PF08447
(PAS_3) 		4 GLY A 109
ALA A   0
THR A  75
SER A  -2
 None
 0.89A 1c9sT-3icyA:
undetectable
1c9sU-3icyA:
undetectable		 1c9sT-3icyA:
23.66
1c9sU-3icyA:
23.66
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.
3iha SALT-TOLERANT
GLUTAMINASE

(Micrococcus
luteus) 		PF04960
(Glutaminase) 		4 GLY A 116
THR A  70
HIS A 121
SER A  66
 None
 0.58A 1c9sT-3ihaA:
undetectable
1c9sU-3ihaA:
undetectable		 1c9sT-3ihaA:
7.68
1c9sU-3ihaA:
7.68
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.
3k4u BINDING COMPONENT OF
ABC TRANSPORTER

(Wolinella
succinogenes) 		PF00497
(SBP_bac_3) 		4 GLY A  90
ALA A 124
THR A 185
THR A  71
 None
None
None
LYS  A 501 (-4.2A)
 0.85A 1c9sT-3k4uA:
undetectable
1c9sU-3k4uA:
undetectable		 1c9sT-3k4uA:
19.60
1c9sU-3k4uA:
19.60
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.
3k96 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
[NAD(P)+]

(Coxiella
burnetii) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		4 GLY A 184
ALA A 155
THR A 236
SER A 153
 None
 0.92A 1c9sT-3k96A:
undetectable
1c9sU-3k96A:
undetectable		 1c9sT-3k96A:
13.90
1c9sU-3k96A:
13.90
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.
3lda DNA REPAIR PROTEIN
RAD51

(Saccharomyces
cerevisiae) 		PF08423
(Rad51)
PF14520
(HHH_5) 		4 GLY A 174
ALA A 320
THR A 181
SER A 179
 None
 0.90A 1c9sT-3ldaA:
undetectable
1c9sU-3ldaA:
undetectable		 1c9sT-3ldaA:
11.75
1c9sU-3ldaA:
11.75
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.
3mi6 ALPHA-GALACTOSIDASE

(Lactobacillus
brevis) 		PF02065
(Melibiase)
PF16874
(Glyco_hydro_36C)
PF16875
(Glyco_hydro_36N) 		4 GLY A  37
THR A  16
HIS A  18
THR A  19
 None
 0.92A 1c9sT-3mi6A:
undetectable
1c9sU-3mi6A:
undetectable		 1c9sT-3mi6A:
6.47
1c9sU-3mi6A:
6.47
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.
3n1t HIT-LIKE PROTEIN
HINT

(Escherichia
coli) 		PF01230
(HIT) 		4 GLY A 107
ALA A  73
HIS A  39
THR A  38
 None
 0.91A 1c9sT-3n1tA:
undetectable
1c9sU-3n1tA:
undetectable		 1c9sT-3n1tA:
22.22
1c9sU-3n1tA:
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.
3nqx SECRETED
METALLOPROTEASE
MCP02

(Pseudoalteromonas
sp. SM9913) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 GLY A 365
ALA A 370
THR A 352
SER A 372
 None
None
None
ZN  A   1 ( 4.9A)
 0.90A 1c9sT-3nqxA:
undetectable
1c9sU-3nqxA:
undetectable		 1c9sT-3nqxA:
14.98
1c9sU-3nqxA:
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.
3p3l CYTOCHROME P450

(Streptomyces
thioluteus) 		PF00067
(p450) 		4 GLY A 103
THR A 110
HIS A 107
THR A 106
 None
 0.81A 1c9sT-3p3lA:
undetectable
1c9sU-3p3lA:
undetectable		 1c9sT-3p3lA:
10.84
1c9sU-3p3lA:
10.84
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.
3rwb PYRIDOXAL
4-DEHYDROGENASE

(Mesorhizobium
loti) 		PF13561
(adh_short_C2) 		5 GLY A 160
ALA A 140
THR A 116
THR A 165
SER A 138
 None
 1.20A 1c9sT-3rwbA:
undetectable
1c9sU-3rwbA:
undetectable		 1c9sT-3rwbA:
16.06
1c9sU-3rwbA:
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.
3ukf UDP-GALACTOPYRANOSE
MUTASE

(Aspergillus
fumigatus) 		PF13450
(NAD_binding_8) 		4 GLY A 446
ALA A 468
THR A 480
HIS A 460
 FDA  A 600 (-3.2A)
None
None
None
 0.81A 1c9sT-3ukfA:
undetectable
1c9sU-3ukfA:
undetectable		 1c9sT-3ukfA:
11.33
1c9sU-3ukfA:
11.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vm7 ALPHA-AMYLASE

(Malbranchea
cinnamomea) 		PF00128
(Alpha-amylase)
PF09260
(DUF1966) 		4 GLY A 473
THR A 412
HIS A 411
THR A 425
 None
 0.68A 1c9sT-3vm7A:
undetectable
1c9sU-3vm7A:
undetectable		 1c9sT-3vm7A:
8.13
1c9sU-3vm7A:
8.13
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.
3vz0 PUTATIVE
NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF00171
(Aldedh) 		4 GLY A 391
ALA A 382
THR A 410
SER A 385
 None
 0.69A 1c9sT-3vz0A:
undetectable
1c9sU-3vz0A:
undetectable		 1c9sT-3vz0A:
10.20
1c9sU-3vz0A:
10.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zte TRYPTOPHAN OPERON
RNA-BINDING
ATTENUATION PROTEIN
(TRAP)

(Bacillus
licheniformis) 		PF02081
(TrpBP) 		4 GLY A  23
THR A  49
HIS A  51
THR A  52
 TRP  A  80 (-3.5A)
TRP  A  80 (-2.8A)
None
TRP  A  80 (-3.6A)
 0.19A 1c9sT-3zteA:
14.3
1c9sU-3zteA:
14.3		 1c9sT-3zteA:
78.21
1c9sU-3zteA:
78.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzl TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
halodurans) 		PF02081
(TrpBP) 		5 GLY A  23
ALA A  46
THR A  49
HIS A  51
THR A  52
 TRP  A  81 (-3.5A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
None
TRP  A  81 (-3.7A)
 0.26A 1c9sT-3zzlA:
13.1
1c9sU-3zzlA:
13.1		 1c9sT-3zzlA:
71.43
1c9sU-3zzlA:
71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzq TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		4 GLY A  23
ALA A  46
THR A  49
THR A  52
 TRP  A  81 (-3.4A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.8A)
 0.11A 1c9sT-3zzqA:
13.7
1c9sU-3zzqA:
13.7		 1c9sT-3zzqA:
80.00
1c9sU-3zzqA:
80.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzs TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		5 GLY A  23
ALA A  46
THR A  49
HIS A  51
THR A  52
 TRP  A1072 (-3.5A)
TRP  A1072 ( 3.8A)
TRP  A1072 (-2.9A)
None
TRP  A1072 (-3.8A)
 0.17A 1c9sT-3zzsA:
13.5
1c9sU-3zzsA:
13.6		 1c9sT-3zzsA:
100.00
1c9sU-3zzsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4b27 TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		5 GLY A  23
ALA A  46
THR A  49
HIS A  51
THR A  52
 GLY  A  23 (-0.0A)
ALA  A  46 ( 0.0A)
THR  A  49 (-0.8A)
HIS  A  51 ( 1.0A)
THR  A  52 (-0.8A)
 0.27A 1c9sT-4b27A:
13.1
1c9sU-4b27A:
13.2		 1c9sT-4b27A:
76.32
1c9sU-4b27A:
76.32
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.
4b52 BACILLOLYSIN

(Paenibacillus
polymyxa) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 GLY A 155
ALA A 160
THR A 142
SER A 162
 None
None
None
ZN  A 401 ( 4.9A)
 0.88A 1c9sT-4b52A:
undetectable
1c9sU-4b52A:
undetectable		 1c9sT-4b52A:
12.83
1c9sU-4b52A:
12.83
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.
4c22 L-FUCOSE ISOMERASE

(Streptococcus
pneumoniae) 		PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2) 		4 GLY A 400
THR A 499
THR A 449
THR A 395
 None
None
None
EDO  A1590 (-4.9A)
 0.75A 1c9sT-4c22A:
undetectable
1c9sU-4c22A:
undetectable		 1c9sT-4c22A:
8.11
1c9sU-4c22A:
8.11
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.
4d9i DIAMINOPROPIONATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00291
(PALP) 		4 GLY A 121
ALA A 128
THR A 117
THR A 119
 None
 0.89A 1c9sT-4d9iA:
undetectable
1c9sU-4d9iA:
undetectable		 1c9sT-4d9iA:
11.42
1c9sU-4d9iA:
11.42
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.
4e2p CYTOCHROME P450
107B1 (P450CVIIB1)

(Streptomyces
himastatinicus) 		PF00067
(p450) 		4 GLY A 340
ALA A  43
HIS A 344
THR A 286
 HEM  A 401 ( 4.1A)
None
HEM  A 401 (-3.9A)
HEM  A 401 (-3.3A)
 0.80A 1c9sT-4e2pA:
undetectable
1c9sU-4e2pA:
undetectable		 1c9sT-4e2pA:
10.50
1c9sU-4e2pA:
10.50
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.
4hcx ISOCITRATE
DEHYDROGENASE [NADP]

(Mycobacterium
tuberculosis) 		PF00180
(Iso_dh) 		4 GLY A 277
THR A 109
HIS A 136
SER A 199
 None
 0.78A 1c9sT-4hcxA:
undetectable
1c9sU-4hcxA:
undetectable		 1c9sT-4hcxA:
11.49
1c9sU-4hcxA:
11.49
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.
4i6m ACTIN-LIKE PROTEIN
ARP9

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		4 GLY B 191
THR B 340
THR B 339
THR B 169
 None
 0.87A 1c9sT-4i6mB:
undetectable
1c9sU-4i6mB:
undetectable		 1c9sT-4i6mB:
11.93
1c9sU-4i6mB:
11.93
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.
4ihq FLAI ATPASE

(Sulfolobus
acidocaldarius) 		PF00437
(T2SSE) 		4 GLY A 267
THR A 229
THR A 270
THR A 239
 ADP  A 601 (-3.1A)
None
ADP  A 601 (-3.2A)
ADP  A 601 (-2.9A)
 0.74A 1c9sT-4ihqA:
undetectable
1c9sU-4ihqA:
undetectable		 1c9sT-4ihqA:
11.31
1c9sU-4ihqA:
11.31
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.
4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN

(Rhodopirellula
baltica) 		PF13458
(Peripla_BP_6) 		4 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.90A 1c9sT-4kv7A:
undetectable
1c9sU-4kv7A:
undetectable		 1c9sT-4kv7A:
13.40
1c9sU-4kv7A:
13.40
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.
4obm UNCHARACTERIZED
PROTEIN

([Eubacterium]
siraeum) 		no annotation 4 GLY A 113
ALA A 274
THR A 280
THR A  67
 None
 0.72A 1c9sT-4obmA:
undetectable
1c9sU-4obmA:
undetectable		 1c9sT-4obmA:
16.02
1c9sU-4obmA:
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.
4ov4 2-ISOPROPYLMALATE
SYNTHASE

(Leptospira
biflexa) 		PF00682
(HMGL-like) 		5 GLY A 213
ALA A 217
THR A 244
HIS A 209
SER A 219
 None
None
None
ZN  A 401 ( 3.4A)
None
 1.16A 1c9sT-4ov4A:
undetectable
1c9sU-4ov4A:
undetectable		 1c9sT-4ov4A:
11.11
1c9sU-4ov4A:
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.
4ov4 2-ISOPROPYLMALATE
SYNTHASE

(Leptospira
biflexa) 		PF00682
(HMGL-like) 		4 GLY A 236
ALA A 215
THR A 249
SER A 219
 None
 0.83A 1c9sT-4ov4A:
undetectable
1c9sU-4ov4A:
undetectable		 1c9sT-4ov4A:
11.11
1c9sU-4ov4A:
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.
4q0g PROBABLE
ACETYL-/PROPIONYL-CO
A CARBOXYLASE (BETA
SUBUNIT) ACCD1

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		5 GLY A  84
ALA A  71
HIS A 119
THR A 115
THR A  87
 None
 1.35A 1c9sT-4q0gA:
undetectable
1c9sU-4q0gA:
undetectable		 1c9sT-4q0gA:
9.33
1c9sU-4q0gA:
9.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qdi UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE

(Acinetobacter
baumannii) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 GLY A 174
ALA A 215
THR A 120
THR A 184
 None
 0.87A 1c9sT-4qdiA:
undetectable
1c9sU-4qdiA:
undetectable		 1c9sT-4qdiA:
9.87
1c9sU-4qdiA:
9.87
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.
4rl6 SACCHAROPINE
DEHYDROGENASE

(Streptococcus
pneumoniae) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		4 GLY A 191
ALA A 361
THR A 321
HIS A 194
 None
 0.88A 1c9sT-4rl6A:
undetectable
1c9sU-4rl6A:
undetectable		 1c9sT-4rl6A:
11.47
1c9sU-4rl6A:
11.47
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.
4rl6 SACCHAROPINE
DEHYDROGENASE

(Streptococcus
pneumoniae) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		4 GLY A 323
ALA A 361
HIS A 194
THR A 321
 None
 0.91A 1c9sT-4rl6A:
undetectable
1c9sU-4rl6A:
undetectable		 1c9sT-4rl6A:
11.47
1c9sU-4rl6A:
11.47
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.
4umv ZINC-TRANSPORTING
ATPASE

(Shigella sonnei) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		4 GLY A 289
ALA A 589
THR A 583
THR A 442
 BEF  A1732 (-3.0A)
None
BEF  A1732 (-4.2A)
None
 0.77A 1c9sT-4umvA:
undetectable
1c9sU-4umvA:
undetectable		 1c9sT-4umvA:
7.07
1c9sU-4umvA:
7.07
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.
4wt7 ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (RIBOSE)

(Agrobacterium
vitis) 		PF13407
(Peripla_BP_4) 		4 GLY A 249
ALA A 255
THR A 264
SER A 282
 None
 0.92A 1c9sT-4wt7A:
undetectable
1c9sU-4wt7A:
undetectable		 1c9sT-4wt7A:
11.53
1c9sU-4wt7A:
11.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xfj ARGININOSUCCINATE
SYNTHASE

(Mycolicibacterium
thermoresistibile) 		PF00764
(Arginosuc_synth) 		4 GLY A 225
THR A 291
HIS A 334
SER A 355
 None
 0.76A 1c9sT-4xfjA:
undetectable
1c9sU-4xfjA:
undetectable		 1c9sT-4xfjA:
8.68
1c9sU-4xfjA:
8.68
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.
4ywe PUTATIVE ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		4 GLY A 251
ALA A 430
HIS A 453
THR A 405
 None
 0.80A 1c9sT-4yweA:
undetectable
1c9sU-4yweA:
undetectable		 1c9sT-4yweA:
8.54
1c9sU-4yweA:
8.54
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.
4zut CLASSICAL MHC CLASS
I ANTIGEN

(Equus caballus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 GLY A  77
ALA A  11
HIS A  82
SER A  13
 None
 0.92A 1c9sT-4zutA:
undetectable
1c9sU-4zutA:
undetectable		 1c9sT-4zutA:
15.59
1c9sU-4zutA:
15.59
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.
5c16 MYOTUBULARIN-RELATED
PROTEIN 1

(Homo sapiens) 		PF02893
(GRAM)
PF06602
(Myotub-related) 		4 GLY A 441
THR A 449
THR A 445
SER A 292
 PO4  A 701 (-3.5A)
None
None
None
 0.68A 1c9sT-5c16A:
undetectable
1c9sU-5c16A:
undetectable		 1c9sT-5c16A:
8.93
1c9sU-5c16A:
8.93
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.
5dni PUTATIVE
L(+)-TARTRATE
DEHYDRATASE SUBUNIT
BETA

(Methanocaldococcus
jannaschii) 		PF05683
(Fumerase_C) 		4 GLY A  78
HIS A  60
THR A  80
THR A  30
 GOL  A 201 (-3.4A)
None
None
None
 0.86A 1c9sT-5dniA:
undetectable
1c9sU-5dniA:
undetectable		 1c9sT-5dniA:
19.89
1c9sU-5dniA:
19.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eex TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		5 GLY A  23
ALA A  46
THR A  49
HIS A  51
THR A  52
 None
 0.19A 1c9sT-5eexA:
15.4
1c9sU-5eexA:
15.5		 1c9sT-5eexA:
100.00
1c9sU-5eexA:
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.
5fcs DIABODY

(Homo sapiens) 		PF07686
(V-set) 		4 GLY H 118
THR H  11
THR H 107
THR H 146
 None
 0.90A 1c9sT-5fcsH:
undetectable
1c9sU-5fcsH:
undetectable		 1c9sT-5fcsH:
14.23
1c9sU-5fcsH:
14.23
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.
5ftx SURFACE LAYER
PROTEIN

(Geobacillus
stearothermophilus) 		no annotation 4 GLY A 522
ALA A 487
THR A 455
THR A 484
 None
 0.92A 1c9sT-5ftxA:
undetectable
1c9sU-5ftxA:
undetectable		 1c9sT-5ftxA:
7.99
1c9sU-5ftxA:
7.99
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.
5fub PROTEIN ARGININE
METHYLTRANSFERASE 2

(Danio rerio) 		PF13649
(Methyltransf_25) 		4 GLY A 127
HIS A 153
THR A 154
SER A 148
 None
None
None
SAH  A 409 ( 4.2A)
 0.82A 1c9sT-5fubA:
undetectable
1c9sU-5fubA:
undetectable		 1c9sT-5fubA:
14.50
1c9sU-5fubA:
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.
5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2

(Mus musculus) 		PF05175
(MTS) 		4 GLY A 161
HIS A 187
THR A 188
SER A 182
 None
None
None
SAH  A1446 ( 4.4A)
 0.83A 1c9sT-5fulA:
undetectable
1c9sU-5fulA:
undetectable		 1c9sT-5fulA:
10.25
1c9sU-5fulA:
10.25
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.
5gaf SIGNAL RECOGNITION
PARTICLE PROTEIN

(Escherichia
coli) 		PF00466
(Ribosomal_L10) 		4 GLY i  87
ALA i 259
HIS i 264
THR i 266
 None
 0.84A 1c9sT-5gafi:
undetectable
1c9sU-5gafi:
undetectable		 1c9sT-5gafi:
12.30
1c9sU-5gafi:
12.30
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.
5gkv ESTERASE A

(Caulobacter
vibrioides) 		PF00144
(Beta-lactamase) 		4 GLY A 119
ALA A 227
HIS A 116
THR A 161
 None
 0.86A 1c9sT-5gkvA:
undetectable
1c9sU-5gkvA:
undetectable		 1c9sT-5gkvA:
9.87
1c9sU-5gkvA:
9.87
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.
5gkx UNCHARACTERIZED
PROTEIN

(Thermococcus
onnurineus) 		PF14336
(DUF4392) 		4 GLY A  62
ALA A  58
THR A  84
THR A  48
 None
 0.87A 1c9sT-5gkxA:
undetectable
1c9sU-5gkxA:
undetectable		 1c9sT-5gkxA:
16.60
1c9sU-5gkxA:
16.60
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.
5hvo ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)

(Aspergillus
fumigatus) 		PF00982
(Glyco_transf_20) 		4 GLY A 387
ALA A 415
THR A 211
SER A 417
 VDM  A 502 (-3.7A)
None
None
None
 0.90A 1c9sT-5hvoA:
undetectable
1c9sU-5hvoA:
undetectable		 1c9sT-5hvoA:
11.30
1c9sU-5hvoA:
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.
5j84 DIHYDROXY-ACID
DEHYDRATASE

(Rhizobium
leguminosarum) 		PF00920
(ILVD_EDD) 		4 GLY A 274
ALA A 400
THR A 377
THR A 308
 None
 0.83A 1c9sT-5j84A:
undetectable
1c9sU-5j84A:
undetectable		 1c9sT-5j84A:
8.03
1c9sU-5j84A:
8.03
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.
5jwy PHOSPHATIDYLGLYCEROP
HOSPHATASE B

(Escherichia
coli) 		PF01569
(PAP2) 		4 GLY A 196
ALA A  40
HIS A 163
THR A  47
 None
None
46E  A 301 ( 3.9A)
None
 0.91A 1c9sT-5jwyA:
undetectable
1c9sU-5jwyA:
undetectable		 1c9sT-5jwyA:
13.90
1c9sU-5jwyA:
13.90
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.
5jxf ASP/GLU-SPECIFIC
DIPEPTIDYL-PEPTIDASE

(Flavobacterium
psychrophilum) 		PF10459
(Peptidase_S46) 		4 GLY A 635
ALA A 648
THR A 570
HIS A 638
 None
 0.73A 1c9sT-5jxfA:
0.0
1c9sU-5jxfA:
undetectable		 1c9sT-5jxfA:
7.11
1c9sU-5jxfA:
7.11
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.
5lt9 METHYL-ACCEPTING
CHEMOTAXIS PROTEIN
PCTB

(Pseudomonas
aeruginosa) 		PF02743
(dCache_1) 		4 GLY A 171
ALA A 132
THR A 141
THR A 155
 None
 0.92A 1c9sT-5lt9A:
undetectable
1c9sU-5lt9A:
undetectable		 1c9sT-5lt9A:
12.90
1c9sU-5lt9A:
12.90
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.
5o0s GLUCOSYLCERAMIDASE

(Thermoanaerobacterium
xylanolyticum) 		PF04685
(DUF608)
PF12215
(Glyco_hydr_116N)
PF17168
(DUF5127) 		4 GLY A 317
THR A 286
THR A 285
THR A 311
 None
 0.84A 1c9sT-5o0sA:
undetectable
1c9sU-5o0sA:
undetectable		 1c9sT-5o0sA:
6.51
1c9sU-5o0sA:
6.51
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.
5t65 METHYL-ACCEPTING
CHEMOTAXIS PROTEIN
PCTA

(Pseudomonas
aeruginosa) 		PF02743
(dCache_1) 		4 GLY A 171
ALA A 132
THR A 141
THR A 155
 None
 0.91A 1c9sT-5t65A:
undetectable
1c9sU-5t65A:
undetectable		 1c9sT-5t65A:
15.76
1c9sU-5t65A:
15.76
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.
5wh8 PUTATIVE
CARBOHYDRATE-ACTIVE
ENZYME

(uncultured
organism) 		no annotation 5 GLY A 294
ALA A 328
THR A 287
THR A 288
SER A 346
 None
 1.46A 1c9sT-5wh8A:
undetectable
1c9sU-5wh8A:
undetectable		 1c9sT-5wh8A:
undetectable
1c9sU-5wh8A:
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.
5ygr DIAMINOPROPIONATE
AMMONIA LYASE

(Salmonella
enterica) 		no annotation 4 GLY A 126
ALA A 133
THR A 122
THR A 124
 PO4  A 504 (-4.5A)
None
None
PO4  A 504 (-3.6A)
 0.90A 1c9sT-5ygrA:
undetectable
1c9sU-5ygrA:
undetectable		 1c9sT-5ygrA:
undetectable
1c9sU-5ygrA:
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.
5z6o PROTEASE

(Penicillium
cyclopium) 		no annotation 4 GLY A 200
ALA A 185
THR A 271
SER A 193
 None
 0.89A 1c9sT-5z6oA:
undetectable
1c9sU-5z6oA:
undetectable		 1c9sT-5z6oA:
undetectable
1c9sU-5z6oA:
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.
6eqn TRYPTOPHAN SYNTHASE
BETA CHAIN 2

(Sulfobacillus) 		no annotation 4 GLY B 137
ALA B 144
THR B 132
THR B 134
 None
 0.90A 1c9sT-6eqnB:
undetectable
1c9sU-6eqnB:
undetectable		 1c9sT-6eqnB:
undetectable
1c9sU-6eqnB:
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.
6fc0 EUKARYOTIC
TRANSLATION
INITIATION FACTOR
4E-LIKE PROTEIN

(Chaetomium
thermophilum) 		no annotation 4 ALA A 239
HIS A 233
THR A 234
THR A 182
 None
 0.89A 1c9sT-6fc0A:
undetectable
1c9sU-6fc0A:
undetectable		 1c9sT-6fc0A:
undetectable
1c9sU-6fc0A:
undetectable