SIMILAR PATTERNS OF AMINO ACIDS FOR 1SQF_A_SAMA430_0

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.
1cx1 ENDOGLUCANASE C

(Cellulomonas
fimi) 		PF02018
(CBM_4_9) 		5 ALA A 136
GLY A  44
GLY A  43
GLY A  98
PRO A  79
 None
 1.04A 1sqfA-1cx1A:
undetectable		 1sqfA-1cx1A:
17.41
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.
1dct PROTEIN
(MODIFICATION
METHYLASE HAEIII)

(Haemophilus
influenzae) 		PF00145
(DNA_methylase) 		5 GLY A  11
GLY A  12
ASP A  31
ASP A  50
PRO A  70
 None
 0.55A 1sqfA-1dctA:
9.5		 1sqfA-1dctA:
20.63
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.
1elj MALTODEXTRIN-BINDING
PROTEIN

(Pyrococcus
furiosus) 		PF13416
(SBP_bac_8) 		5 ALA A 351
GLY A 347
GLY A 346
ILE A 364
GLY A 192
 None
 1.04A 1sqfA-1eljA:
undetectable		 1sqfA-1eljA:
23.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g38 MODIFICATION
METHYLASE TAQI

(Thermus
aquaticus) 		PF07669
(Eco57I)
PF12950
(TaqI_C) 		6 ALA A  49
GLY A  51
ILE A  72
ASP A  73
ASP A  89
PRO A 107
 NEA  A 500 ( 3.7A)
None
NEA  A 500 (-3.8A)
None
NEA  A 500 (-3.4A)
NEA  A 500 (-3.8A)
 0.82A 1sqfA-1g38A:
11.1		 1sqfA-1g38A:
23.40
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.
1gso PROTEIN (GLYCINAMIDE
RIBONUCLEOTIDE
SYNTHETASE)

(Escherichia
coli) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 ALA A 367
GLY A   9
ASP A 349
GLY A 348
ARG A 346
 None
 0.75A 1sqfA-1gsoA:
3.8		 1sqfA-1gsoA:
25.86
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.
1h74 HOMOSERINE KINASE

(Methanocaldococcus
jannaschii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 CYH A  13
ALA A 145
GLY A 148
GLY A 149
GLY A  88
 None
 0.82A 1sqfA-1h74A:
undetectable		 1sqfA-1h74A:
22.05
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.
1imv PIGMENT
EPITHELIUM-DERIVED
FACTOR

(Homo sapiens) 		PF00079
(Serpin) 		5 GLY A 195
LYS A 194
ASP A 394
GLY A 397
ARG A 396
 None
 1.03A 1sqfA-1imvA:
undetectable		 1sqfA-1imvA:
22.83
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.
1iy9 SPERMIDINE SYNTHASE

(Bacillus
subtilis) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLY A  88
GLY A  89
ILE A 108
ASP A 109
ASP A 138
GLY A 139
 None
 0.64A 1sqfA-1iy9A:
8.3		 1sqfA-1iy9A:
20.84
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.
1j0h NEOPULLULANASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		5 ALA A 416
GLY A 451
GLY A 368
ARG A 367
PRO A 409
 None
 0.97A 1sqfA-1j0hA:
undetectable		 1sqfA-1j0hA:
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.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLY A  86
GLY A  87
ILE A 105
ASP A 106
ASP A 141
GLY A 142
 None
 0.45A 1sqfA-1mjfA:
5.9		 1sqfA-1mjfA:
23.63
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.
1n7f AMPA RECEPTOR
INTERACTING PROTEIN
GRIP

(Rattus
norvegicus) 		PF00595
(PDZ) 		5 ALA A 707
GLY A 705
GLY A 704
LYS A 703
GLY A 716
 None
 0.97A 1sqfA-1n7fA:
undetectable		 1sqfA-1n7fA:
13.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qib 72 KDA TYPE IV
COLLAGENASE

(Homo sapiens) 		PF00413
(Peptidase_M10) 		5 ALA A 167
GLY A 176
GLY A 175
ASP A 181
GLY A 147
 None
CA  A 504 ( 4.6A)
CA  A 504 (-4.6A)
CA  A 503 (-3.6A)
None
 1.05A 1sqfA-1qibA:
undetectable		 1sqfA-1qibA:
17.66
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.
1qlb FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Wolinella
succinogenes) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 ALA A  16
GLY A  14
GLY A  13
GLY A 374
ARG A 376
 FAD  A1656 (-3.4A)
FAD  A1656 (-3.5A)
FAD  A1656 (-3.4A)
CA  A1658 ( 4.1A)
None
 0.96A 1sqfA-1qlbA:
undetectable		 1sqfA-1qlbA:
22.63
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.
1ryy ALPHA-AMINO ACID
ESTER HYDROLASE

(Acetobacter
pasteurianus) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		5 GLY A 263
GLY A 262
ILE A 267
ASP A 266
GLY A 292
 None
 0.98A 1sqfA-1ryyA:
undetectable		 1sqfA-1ryyA:
20.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1sqg SUN PROTEIN

(Escherichia
coli) 		PF01029
(NusB)
PF01189
(Methyltr_RsmB-F) 		8 CYH A 254
ALA A 256
GLY A 258
GLY A 259
ASP A 303
GLY A 304
ARG A 305
PRO A 324
 None
 0.59A 1sqfA-1sqgA:
61.3		 1sqfA-1sqgA:
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.
1va8 MAGUK P55 SUBFAMILY
MEMBER 5

(Mus musculus) 		PF00595
(PDZ) 		5 ALA A  61
GLY A  59
GLY A  58
LYS A  57
GLY A  70
 None
 1.05A 1sqfA-1va8A:
undetectable		 1sqfA-1va8A:
13.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		5 GLY A  50
GLY A  51
ILE A  68
ASP A  93
ARG A  95
 None
None
SAM  A 302 (-3.7A)
SAM  A 302 (-3.4A)
None
 0.45A 1sqfA-1ve3A:
12.8		 1sqfA-1ve3A:
18.54
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.
1wlh GELATION FACTOR

(Dictyostelium
discoideum) 		PF00630
(Filamin) 		5 ALA A 670
GLY A 660
GLY A 658
ASP A 720
GLY A 750
 None
 1.02A 1sqfA-1wlhA:
undetectable		 1sqfA-1wlhA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLY A 132
GLY A 133
ILE A 152
ASP A 153
ASP A 182
GLY A 183
 None
 0.55A 1sqfA-1xj5A:
10.2		 1sqfA-1xj5A:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y3n ALGQ1

(Sphingomonas
sp. A1) 		PF01547
(SBP_bac_1) 		5 GLY A  84
GLY A  87
ASP A  78
ASP A  74
GLY A  73
 None
 1.04A 1sqfA-1y3nA:
undetectable		 1sqfA-1y3nA:
22.04
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.
2b2c SPERMIDINE SYNTHASE

(Caenorhabditis
elegans) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 120
GLY A 121
ILE A 140
ASP A 141
GLY A 171
 None
 0.69A 1sqfA-2b2cA:
9.2		 1sqfA-2b2cA:
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.
2b9e NOL1/NOP2/SUN DOMAIN
FAMILY, MEMBER 5
ISOFORM 2

(Homo sapiens) 		PF01189
(Methyltr_RsmB-F) 		6 CYH A 234
ALA A 236
GLY A 238
LYS A 240
ASP A 260
ASP A 285
 SAM  A1201 (-3.8A)
SAM  A1201 (-4.1A)
SAM  A1201 (-3.9A)
SAM  A1201 (-3.1A)
None
SAM  A1201 (-3.6A)
 0.78A 1sqfA-2b9eA:
26.7		 1sqfA-2b9eA:
24.51
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.
2dw6 BLL6730 PROTEIN

(Bradyrhizobium
japonicum) 		PF13378
(MR_MLE_C) 		5 GLY A 351
GLY A 352
ASP A 122
ASP A 117
GLY A 298
 None
 1.05A 1sqfA-2dw6A:
undetectable		 1sqfA-2dw6A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2frx HYPOTHETICAL PROTEIN
YEBU

(Escherichia
coli) 		PF01189
(Methyltr_RsmB-F)
PF13636
(Methyltranf_PUA)
PF17125
(Methyltr_RsmF_N) 		5 ALA A 127
GLY A 129
GLY A 177
ARG A 178
PRO A 196
 None
 0.90A 1sqfA-2frxA:
32.3		 1sqfA-2frxA:
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.
2hal HEPATITIS A PROTEASE
3C

(Hepatovirus A) 		PF00548
(Peptidase_C3) 		5 ALA A 193
GLY A 194
GLY A 195
ASP A  84
ASP A 158
 None
 0.96A 1sqfA-2halA:
undetectable		 1sqfA-2halA:
19.53
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.
2i9k MODIFICATION
METHYLASE HHAI

(Haemophilus
haemolyticus) 		PF00145
(DNA_methylase) 		6 ALA A  19
GLY A  22
GLY A  23
ILE A  61
ASP A 103
PRO A  80
 None
None
SAH  A 328 (-3.6A)
SAH  A 328 (-4.3A)
None
SAH  A 328 (-4.0A)
 1.21A 1sqfA-2i9kA:
9.0		 1sqfA-2i9kA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i9k MODIFICATION
METHYLASE HHAI

(Haemophilus
haemolyticus) 		PF00145
(DNA_methylase) 		5 GLY A  22
GLY A  23
ASP A  42
ASP A  60
PRO A  80
 None
SAH  A 328 (-3.6A)
None
SAH  A 328 (-3.6A)
SAH  A 328 (-4.0A)
 0.59A 1sqfA-2i9kA:
9.0		 1sqfA-2i9kA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jg5 FRUCTOSE 1-PHOSPHATE
KINASE

(Staphylococcus
aureus) 		PF00294
(PfkB) 		5 ALA A 223
GLY A 222
GLY A 220
GLY A 203
PRO A 180
 None
 0.98A 1sqfA-2jg5A:
3.1		 1sqfA-2jg5A:
21.62
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.
2jif SHORT/BRANCHED CHAIN
SPECIFIC ACYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 ALA A 298
GLY A 296
GLY A 293
ILE A 377
GLY A 379
 None
 0.96A 1sqfA-2jifA:
undetectable		 1sqfA-2jifA:
20.26
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.
2nlz CEPHALOSPORIN
ACYLASE

(Bacillus
halodurans) 		PF01019
(G_glu_transpept) 		5 ALA A 525
GLY A 526
GLY A 527
ASP A 518
GLY A 368
 None
 0.92A 1sqfA-2nlzA:
undetectable		 1sqfA-2nlzA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nvv ACETYL-COA
HYDROLASE/TRANSFERAS
E FAMILY PROTEIN

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 GLY A 141
GLY A  30
ASP A 381
GLY A 378
PRO A  82
 GLY  A 141 ( 0.0A)
GLY  A  30 ( 0.0A)
ASP  A 381 ( 0.6A)
GLY  A 378 ( 0.0A)
PRO  A  82 ( 1.1A)
 0.96A 1sqfA-2nvvA:
undetectable		 1sqfA-2nvvA:
21.22
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.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 128
GLY A 129
ILE A 148
ASP A 149
ASP A 178
 None
None
S4M  A 501 (-3.9A)
None
S4M  A 501 (-3.3A)
 0.40A 1sqfA-2pt6A:
9.9		 1sqfA-2pt6A:
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.
2pzf CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran) 		5 GLY A 545
GLY A 544
ILE A 530
ASP A 529
ARG A 518
 None
 1.03A 1sqfA-2pzfA:
undetectable		 1sqfA-2pzfA:
20.47
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.
2wdw PUTATIVE HEXOSE
OXIDASE

(Nonomuraea
gerenzanensis) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ALA A 212
GLY A 216
GLY A 217
ASP A 208
ASP A 204
 None
 0.95A 1sqfA-2wdwA:
undetectable		 1sqfA-2wdwA:
21.98
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.
2xts CYTOCHROME

(Paracoccus
pantotrophus) 		PF13442
(Cytochrome_CBB3) 		6 ALA B  71
GLY B  75
GLY B  80
ASP B  68
ASP B 133
PRO B 122
 None
None
None
None
None
HEC  B 500 (-3.7A)
 1.27A 1sqfA-2xtsB:
undetectable		 1sqfA-2xtsB:
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.
2yp1 AROMATIC
PEROXYGENASE

(Agrocybe
aegerita) 		PF01328
(Peroxidase_2) 		5 ALA A 132
GLY A 135
ASP A  85
GLY A 114
PRO A  35
 None
None
None
None
HEM  A 350 (-4.2A)
 0.97A 1sqfA-2yp1A:
undetectable		 1sqfA-2yp1A:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yxl 450AA LONG
HYPOTHETICAL FMU
PROTEIN

(Pyrococcus
horikoshii) 		PF01189
(Methyltr_RsmB-F)
PF17125
(Methyltr_RsmF_N) 		8 ALA A 269
GLY A 271
GLY A 272
LYS A 273
ASP A 293
ASP A 318
ARG A 320
PRO A 339
 SFG  A5748 (-4.3A)
SFG  A5748 (-3.7A)
SFG  A5748 (-3.7A)
SFG  A5748 (-3.3A)
None
SFG  A5748 (-3.7A)
SFG  A5748 (-4.5A)
SFG  A5748 (-4.0A)
 0.72A 1sqfA-2yxlA:
40.8		 1sqfA-2yxlA:
29.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zb4 PROSTAGLANDIN
REDUCTASE 2

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 ALA A 163
GLY A 165
GLY A 339
ILE A 206
ASP A 211
 None
NAP  A 500 (-3.2A)
None
None
None
 0.95A 1sqfA-2zb4A:
7.5		 1sqfA-2zb4A:
21.98
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.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLY A  88
GLY A  89
ILE A 108
ASP A 109
ASP A 144
GLY A 145
 None
 0.49A 1sqfA-2zsuA:
10.2		 1sqfA-2zsuA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a4t PUTATIVE
METHYLTRANSFERASE
MJ0026

(Methanocaldococcus
jannaschii) 		PF01189
(Methyltr_RsmB-F) 		8 CYH A  91
ALA A  93
GLY A  95
GLY A  96
LYS A  97
ILE A 116
ARG A 144
PRO A 165
 SFG  A 500 (-3.8A)
SFG  A 500 (-3.7A)
SFG  A 500 (-4.0A)
SFG  A 500 (-3.5A)
SFG  A 500 (-2.8A)
SFG  A 500 (-3.7A)
None
SFG  A 500 (-3.9A)
 0.58A 1sqfA-3a4tA:
28.8		 1sqfA-3a4tA:
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.
3a4t PUTATIVE
METHYLTRANSFERASE
MJ0026

(Methanocaldococcus
jannaschii) 		PF01189
(Methyltr_RsmB-F) 		8 CYH A  91
ALA A  93
GLY A  95
GLY A  96
LYS A  97
ILE A 116
ASP A 142
ARG A 144
 SFG  A 500 (-3.8A)
SFG  A 500 (-3.7A)
SFG  A 500 (-4.0A)
SFG  A 500 (-3.5A)
SFG  A 500 (-2.8A)
SFG  A 500 (-3.7A)
SFG  A 500 (-4.0A)
None
 0.58A 1sqfA-3a4tA:
28.8		 1sqfA-3a4tA:
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.
3aar ECTONUCLEOSIDE
TRIPHOSPHATE
DIPHOSPHOHYDROLASE I

(Legionella
pneumophila) 		PF01150
(GDA1_CD39) 		6 ALA A  50
GLY A  54
GLY A  84
ILE A 154
ASP A 158
GLY A 156
 None
 1.42A 1sqfA-3aarA:
undetectable		 1sqfA-3aarA:
19.51
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.
3bop BETA-NEUREXIN 2D4

(Mus musculus) 		PF02210
(Laminin_G_2) 		5 GLY A 185
GLY A 184
ILE A 153
ASP A 160
GLY A 151
 None
 0.96A 1sqfA-3bopA:
undetectable		 1sqfA-3bopA:
17.92
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.
3c6m SPERMINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 202
GLY A 203
ILE A 221
ASP A 222
ASP A 255
 None
None
MTA  A 401 (-3.8A)
None
MTA  A 401 (-3.6A)
 0.34A 1sqfA-3c6mA:
11.2		 1sqfA-3c6mA:
22.55
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.
3cjy PUTATIVE
THIOESTERASE

(Novosphingobium
aromaticivorans) 		PF13622
(4HBT_3) 		5 ALA A 153
GLY A 154
GLY A 155
ASP A 241
GLY A 244
 None
None
None
None
GOL  A 263 (-3.1A)
 0.93A 1sqfA-3cjyA:
undetectable		 1sqfA-3cjyA:
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.
3cwc PUTATIVE GLYCERATE
KINASE 2

(Salmonella
enterica) 		PF02595
(Gly_kinase) 		5 ALA A 256
GLY A 254
ILE A 174
ASP A 236
ARG A 235
 None
 1.05A 1sqfA-3cwcA:
undetectable		 1sqfA-3cwcA:
22.63
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.
3dho STREPTOGRAMIN A
ACETYLTRANSFERASE

(Enterococcus
faecium) 		PF00132
(Hexapep) 		5 ALA A 156
GLY A 157
GLY A 158
ASP A 136
GLY A 117
 None
B2M  A 302 (-3.5A)
B2M  A 302 (-4.0A)
None
None
 0.99A 1sqfA-3dhoA:
undetectable		 1sqfA-3dhoA:
18.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e74 ALLANTOINASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		5 GLY A 125
GLY A 124
ASP A 163
ASP A 166
ARG A 226
 KCX  A 146 ( 3.4A)
None
None
None
None
 0.90A 1sqfA-3e74A:
undetectable		 1sqfA-3e74A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3edm SHORT CHAIN
DEHYDROGENASE

(Agrobacterium
fabrum) 		PF13561
(adh_short_C2) 		5 ALA A 153
GLY A 149
GLY A 148
ILE A  96
GLY A  93
 None
 1.02A 1sqfA-3edmA:
8.1		 1sqfA-3edmA:
20.47
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.
3egi TRIMETHYLGUANOSINE
SYNTHASE HOMOLOG

(Homo sapiens) 		PF09445
(Methyltransf_15) 		6 GLY A 702
GLY A 703
ILE A 720
ASP A 721
ASP A 747
PRO A 765
 None
None
ADP  A   3 (-3.8A)
None
ADP  A   3 (-3.4A)
ADP  A   3 (-3.3A)
 0.63A 1sqfA-3egiA:
12.7		 1sqfA-3egiA:
21.87
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.
3eja PROTEIN GH61E

(Thielavia
terrestris) 		PF03443
(Glyco_hydro_61) 		5 ALA A 181
GLY A 148
GLY A 149
GLY A 202
PRO A 184
 None
 1.05A 1sqfA-3ejaA:
undetectable		 1sqfA-3ejaA:
18.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fyd PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		5 GLY A  42
ILE A  60
ASP A  61
ASP A  84
PRO A 103
 None
 0.71A 1sqfA-3fydA:
11.5		 1sqfA-3fydA:
20.79
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.
3g7u CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Escherichia
coli) 		PF00145
(DNA_methylase) 		6 GLY A  11
GLY A  12
ILE A  30
ASP A  31
ASP A  51
PRO A  78
 None
 0.87A 1sqfA-3g7uA:
9.7		 1sqfA-3g7uA:
21.05
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.
3ga7 ACETYL ESTERASE

(Salmonella
enterica) 		PF07859
(Abhydrolase_3) 		5 GLY A  94
GLY A  93
ASP A 222
ASP A 202
ARG A 207
 SEP  A 165 ( 3.5A)
SEP  A 165 ( 3.6A)
None
None
None
 0.84A 1sqfA-3ga7A:
2.9		 1sqfA-3ga7A:
24.33
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.
3gdh TRIMETHYLGUANOSINE
SYNTHASE HOMOLOG

(Homo sapiens) 		PF09445
(Methyltransf_15) 		6 GLY A 702
GLY A 703
ILE A 720
ASP A 721
ASP A 747
PRO A 765
 SAH  A 854 (-4.4A)
SAH  A 854 (-3.0A)
SAH  A 854 (-3.6A)
None
SAH  A 854 (-3.6A)
SAH  A 854 (-3.8A)
 0.68A 1sqfA-3gdhA:
13.5		 1sqfA-3gdhA:
21.05
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.
3gry DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		5 GLY A  42
ILE A  60
ASP A  61
ASP A  84
PRO A 103
 None
SAM  A 300 (-3.9A)
None
SAM  A 300 (-3.7A)
SAM  A 300 (-3.8A)
 0.68A 1sqfA-3gryA:
11.5		 1sqfA-3gryA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hij DIHYDRODIPICOLINATE
SYNTHASE

(Bacillus
anthracis) 		PF00701
(DHDPS) 		5 ALA A  10
GLY A  45
GLY A  44
ILE A   7
GLY A   5
 KPI  A 163 ( 3.2A)
KPI  A 163 ( 3.4A)
None
None
None
 0.97A 1sqfA-3hijA:
undetectable		 1sqfA-3hijA:
21.18
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.
3i09 PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Burkholderia
mallei) 		PF13458
(Peripla_BP_6) 		5 ALA A 126
GLY A 101
ASP A 349
GLY A 350
ARG A 347
 AAE  A 501 (-3.7A)
None
None
None
None
 0.97A 1sqfA-3i09A:
2.5		 1sqfA-3i09A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m4x NOL1/NOP2/SUN FAMILY
PROTEIN

(Enterococcus
faecium) 		PF01189
(Methyltr_RsmB-F)
PF13636
(Methyltranf_PUA)
PF17125
(Methyltr_RsmF_N)
PF17126
(RsmF_methylt_CI) 		7 CYH A 113
ALA A 115
GLY A 117
GLY A 118
LYS A 119
ILE A 138
PRO A 184
 None
 0.45A 1sqfA-3m4xA:
31.2		 1sqfA-3m4xA:
22.24
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.
3m6x RRNA METHYLASE

(Thermus
thermophilus) 		PF01189
(Methyltr_RsmB-F)
PF17125
(Methyltr_RsmF_N)
PF17126
(RsmF_methylt_CI) 		6 ALA A 111
GLY A 113
GLY A 114
LYS A 115
ASP A 135
PRO A 179
 None
 0.52A 1sqfA-3m6xA:
33.6		 1sqfA-3m6xA:
21.75
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.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		5 ALA A 303
GLY A 302
GLY A 301
ASP A 265
GLY A 357
 None
None
None
MAN  A1039 ( 2.9A)
None
 1.03A 1sqfA-3ogrA:
undetectable		 1sqfA-3ogrA:
17.75
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.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE ALPHA-SUBUNIT

(Komagataella
pastoris) 		PF00365
(PFK) 		5 CYH A 501
ALA A 499
GLY A 498
GLY A 497
ILE A 786
 None
 1.02A 1sqfA-3opyA:
undetectable		 1sqfA-3opyA:
17.66
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.
3q75 FARNESYLTRANSFERASE
BETA SUBUNIT

(Cryptococcus
neoformans) 		PF00432
(Prenyltrans) 		5 GLY B 332
GLY B 333
ILE B 485
GLY B 483
PRO B 373
 None
 0.79A 1sqfA-3q75B:
undetectable		 1sqfA-3q75B:
20.98
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.
3qvn MANGANESE-CONTAINING
SUPEROXIDE DISMUTASE

(Candida
albicans) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		5 ALA A  88
GLY A  94
GLY A  95
ILE A  13
ASP A  14
 None
 0.93A 1sqfA-3qvnA:
undetectable		 1sqfA-3qvnA:
19.16
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.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLY A 105
GLY A 106
ILE A 125
ASP A 126
ASP A 155
GLY A 156
 None
None
DSH  A 303 (-3.8A)
None
DSH  A 303 (-3.5A)
DSH  A 303 (-3.7A)
 0.53A 1sqfA-3rw9A:
9.1		 1sqfA-3rw9A:
20.28
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.
3t24 PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		5 GLY A 169
GLY A 168
ASP A 334
ASP A 331
GLY A 330
 None
 0.73A 1sqfA-3t24A:
undetectable		 1sqfA-3t24A:
19.29
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.
3u9s METHYLCROTONYL-COA
CARBOXYLASE,
ALPHA-SUBUNIT

(Pseudomonas
aeruginosa) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 ALA A 119
GLY A 121
ASP A 111
GLY A 110
ARG A 109
 None
 0.86A 1sqfA-3u9sA:
2.5		 1sqfA-3u9sA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uyk NDP-RHAMNOSYLTRANSFE
RASE

(Saccharopolyspora
spinosa) 		PF06722
(DUF1205) 		5 GLY A 293
GLY A 294
ILE A 331
GLY A 328
PRO A 307
 None
 1.04A 1sqfA-3uykA:
2.9		 1sqfA-3uykA:
23.81
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.
4egt MAJOR CAPSID PROTEIN
VP60

(Rabbit
hemorrhagic
disease virus) 		PF00915
(Calici_coat) 		5 ALA A 452
GLY A 270
GLY A 269
ASP A 531
GLY A 527
 None
 1.05A 1sqfA-4egtA:
undetectable		 1sqfA-4egtA:
20.66
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.
4eyg TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		5 GLY A  42
GLY A  41
ASP A 259
GLY A 303
ARG A 301
 None
 1.01A 1sqfA-4eygA:
undetectable		 1sqfA-4eygA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fzv PUTATIVE
METHYLTRANSFERASE
NSUN4

(Homo sapiens) 		PF01189
(Methyltr_RsmB-F) 		9 CYH A 181
ALA A 183
GLY A 185
GLY A 186
LYS A 187
ASP A 237
GLY A 238
ARG A 239
PRO A 257
 SAM  A 401 (-3.9A)
SAM  A 401 (-4.1A)
SAM  A 401 (-3.7A)
SAM  A 401 (-3.9A)
SAM  A 401 (-3.5A)
SAM  A 401 (-3.5A)
SAM  A 401 (-3.5A)
None
SAM  A 401 (-4.0A)
 0.67A 1sqfA-4fzvA:
27.2		 1sqfA-4fzvA:
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.
4g09 HISTIDINOL
DEHYDROGENASE

(Brucella suis) 		PF00815
(Histidinol_dh) 		5 ALA A 197
GLY A 199
ILE A 230
ASP A 231
GLY A 211
 None
 1.05A 1sqfA-4g09A:
2.5		 1sqfA-4g09A:
22.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		5 GLY A  67
GLY A  68
ASP A  87
ASP A 111
PRO A 143
 None
None
None
None
ACT  A 402 ( 4.9A)
 0.74A 1sqfA-4gc5A:
10.4		 1sqfA-4gc5A:
22.84
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.
4hvt POST-PROLINE
CLEAVING ENZYME

(Rickettsia
typhi) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 ALA A 530
GLY A 518
GLY A 519
ILE A 533
ASP A 619
 None
 0.94A 1sqfA-4hvtA:
undetectable		 1sqfA-4hvtA:
20.03
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.
4hvt POST-PROLINE
CLEAVING ENZYME

(Rickettsia
typhi) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 ALA A 530
GLY A 519
ILE A 533
ASP A 619
GLY A 612
 None
 1.00A 1sqfA-4hvtA:
undetectable		 1sqfA-4hvtA:
20.03
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.
4k3j HEPATOCYTE GROWTH
FACTOR

(Homo sapiens) 		PF00089
(Trypsin) 		5 GLY A 675
GLY A 674
ASP A 552
GLY A 555
ARG A 556
 None
 1.01A 1sqfA-4k3jA:
undetectable		 1sqfA-4k3jA:
19.66
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.
4mup AMIDOHYDROLASE

(Agrobacterium
fabrum) 		PF04909
(Amidohydro_2) 		6 ALA A 126
GLY A 125
GLY A 124
ILE A  97
ASP A  98
GLY A 116
 None
 1.32A 1sqfA-4mupA:
undetectable		 1sqfA-4mupA:
22.30
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.
4pf1 PEPTIDASE
S15/COCE/NOND

(Thaumarchaeota
archaeon SCGC
AB-539-E09) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		6 ALA A 182
GLY A 157
GLY A 156
ILE A 296
GLY A 190
PRO A 300
 None
 1.26A 1sqfA-4pf1A:
undetectable		 1sqfA-4pf1A:
20.83
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.
4pqh GLUTATHIONE
TRANSFERASE LAMBDA1

(Populus
trichocarpa) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 GLY A 105
LYS A  49
ASP A 160
GLY A 166
PRO A 110
 None
 1.06A 1sqfA-4pqhA:
undetectable		 1sqfA-4pqhA:
21.11
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.
4tn3 TRIM5/CYCLOPHILIN A
FUSION PROTEIN/T4
LYSOZYME CHIMERA

(Macaca mulatta;
Escherichia
virus T4) 		PF00643
(zf-B_box)
PF00959
(Phage_lysozyme) 		5 ALA A 366
GLY A 331
GLY A 333
ASP A 364
GLY A 354
 None
 1.02A 1sqfA-4tn3A:
undetectable		 1sqfA-4tn3A:
23.55
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.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 128
GLY A 129
ILE A 148
ASP A 149
ASP A 178
 None
None
MTA  A 401 (-3.8A)
None
MTA  A 401 (-3.2A)
 0.37A 1sqfA-4uoeA:
10.2		 1sqfA-4uoeA:
19.77
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.
4w5z CHITINASE 60

(Moritella
marina) 		PF00704
(Glyco_hydro_18) 		5 ALA A 118
GLY A 117
GLY A 116
GLY A  45
ARG A  44
 MPD  A 402 ( 4.3A)
None
None
MPD  A 402 (-3.6A)
None
 1.04A 1sqfA-4w5zA:
undetectable		 1sqfA-4w5zA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yv2 SPERMIDINE SYNTHASE,
PUTATIVE

(Trypanosoma
cruzi) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLY A  99
GLY A 100
ILE A 119
ASP A 120
ASP A 149
GLY A 150
 None
None
S4M  A 301 (-3.9A)
None
S4M  A 301 (-3.9A)
S4M  A 301 (-3.6A)
 0.47A 1sqfA-4yv2A:
9.5		 1sqfA-4yv2A:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zon VERRUCULOGEN
SYNTHASE

(Aspergillus
fumigatus) 		PF05721
(PhyH) 		5 ALA A 165
GLY A 208
GLY A 209
ILE A  32
PRO A 155
 None
 1.06A 1sqfA-4zonA:
undetectable		 1sqfA-4zonA:
23.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dss MP-4

(Mucuna pruriens) 		PF00197
(Kunitz_legume) 		5 ALA B 181
GLY B 182
GLY B 183
ILE B  23
GLY B 177
 None
 1.03A 1sqfA-5dssB:
undetectable		 1sqfA-5dssB:
17.10
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 GLY A 191
GLY A 192
ILE A 209
ASP A 235
PRO A 256
 None
SAM  A 400 (-3.7A)
SAM  A 400 (-3.9A)
SAM  A 400 (-3.4A)
SAM  A 400 (-4.2A)
 0.63A 1sqfA-5e72A:
14.8		 1sqfA-5e72A:
24.94
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.
5h71 ALGQ2

(Sphingomonas
sp.) 		PF01547
(SBP_bac_1) 		5 GLY A  84
GLY A  87
ASP A  78
ASP A  74
GLY A  73
 None
None
None
BEM  A 503 ( 3.7A)
None
 1.02A 1sqfA-5h71A:
undetectable		 1sqfA-5h71A:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hu6 HAPTOGLOBIN-HEMOGLOB
IN RECEPTOR

(Trypanosoma
brucei) 		no annotation 5 ALA D 225
GLY D 222
GLY D 221
ASP D 232
GLY D 231
 None
 1.00A 1sqfA-5hu6D:
undetectable		 1sqfA-5hu6D:
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.
5i6h ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		5 GLY A2038
GLY A2039
ILE A2150
GLY A2148
PRO A2046
 None
 1.03A 1sqfA-5i6hA:
undetectable		 1sqfA-5i6hA:
15.97
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.
5i6i ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		5 GLY A2038
GLY A2039
ILE A2150
GLY A2148
PRO A2046
 None
 1.04A 1sqfA-5i6iA:
undetectable		 1sqfA-5i6iA:
11.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ic7 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		no annotation 5 CYH A 381
GLY A 335
GLY A 336
ASP A 428
GLY A 429
 None
 0.96A 1sqfA-5ic7A:
undetectable		 1sqfA-5ic7A:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jvk UNCHARACTERIZED
PROTEIN

(Bacteroides
cellulosilyticus) 		no annotation 5 GLY A 304
GLY A 303
ILE A 280
ASP A 309
GLY A 283
 None
 0.99A 1sqfA-5jvkA:
undetectable		 1sqfA-5jvkA:
22.01
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.
5nd1 CAPSID PROTEIN
CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1;
Rosellinia
necatrix
quadrivirus 1) 		no annotation
no annotation 		5 ALA B 189
GLY B 188
GLY B 187
ASP B 991
GLY A 505
 None
 0.79A 1sqfA-5nd1B:
undetectable		 1sqfA-5nd1B:
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.
5odb D10 FAB FRAGMENT -
LIGHT CHAIN

(Homo sapiens) 		no annotation 5 GLY B  99
GLY B 100
ASP B  92
ASP B  30
GLY B  29
 None
 0.84A 1sqfA-5odbB:
undetectable		 1sqfA-5odbB:
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.
5tsb MEMBRANE PROTEIN

(Bordetella
bronchiseptica) 		PF02535
(Zip) 		5 ALA A 184
GLY A 182
GLY A 243
ILE A 196
GLY A 192
 None
 1.04A 1sqfA-5tsbA:
undetectable		 1sqfA-5tsbA:
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.
5wcj METHYLTRANSFERASE-LI
KE PROTEIN 13

(Homo sapiens) 		PF01564
(Spermine_synth) 		5 GLY A 504
ILE A 525
ASP A 526
ASP A 551
GLY A 552
 None
SAH  A 705 (-3.6A)
None
SAH  A 705 (-3.4A)
SAH  A 705 (-3.8A)
 0.95A 1sqfA-5wcjA:
11.4		 1sqfA-5wcjA:
20.83
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.
5wcj METHYLTRANSFERASE-LI
KE PROTEIN 13

(Homo sapiens) 		PF01564
(Spermine_synth) 		5 GLY A 505
ILE A 525
ASP A 526
ASP A 551
GLY A 552
 None
SAH  A 705 (-3.6A)
None
SAH  A 705 (-3.4A)
SAH  A 705 (-3.8A)
 0.43A 1sqfA-5wcjA:
11.4		 1sqfA-5wcjA:
20.83
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.
5wwt PUTATIVE
METHYLTRANSFERASE
NSUN6

(Homo sapiens) 		PF01189
(Methyltr_RsmB-F) 		8 CYH A 242
ALA A 244
GLY A 246
GLY A 247
LYS A 248
ASP A 293
GLY A 294
PRO A 325
 None
None
None
None
C  C  72 ( 3.1A)
None
None
None
 0.58A 1sqfA-5wwtA:
31.2		 1sqfA-5wwtA:
28.40
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.
5zb8 PFUENDOQ

(Pyrococcus
furiosus) 		no annotation 5 GLY A 272
ASP A 260
ASP A 281
GLY A 278
ARG A 280
 None
 0.93A 1sqfA-5zb8A:
undetectable		 1sqfA-5zb8A:
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.
6b2y SOLUTE-BINDING
PERIPLASMIC PROTEIN
OF IRON/SIDEROPHORE
ABC TRANSPORTER

(Yersinia pestis) 		no annotation 5 GLY A 242
GLY A 243
LYS A 244
ILE A 277
GLY A 273
 None
 1.04A 1sqfA-6b2yA:
undetectable		 1sqfA-6b2yA:
22.55