SIMILAR PATTERNS OF AMINO ACIDS FOR 6CLX_A_SAMA401

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.
1a4s BETAINE ALDEHYDE
DEHYDROGENASE

(Gadus morhua) 		PF00171
(Aldedh) 		5 ALA A 115
GLY A 337
GLY A 109
PHE A 381
ASP A 328
 None
 1.02A 6clxA-1a4sA:
4.0		 6clxA-1a4sA:
21.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1al8 GLYCOLATE OXIDASE

(Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 ASP A 293
ALA A 302
GLY A 286
ARG A  39
VAL A 251
 None
None
FMN  A 360 (-3.3A)
None
None
 1.23A 6clxA-1al8A:
undetectable		 6clxA-1al8A:
23.98
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.
1d0n HORSE PLASMA
GELSOLIN

(Equus caballus) 		PF00626
(Gelsolin) 		5 ASP A 192
ALA A 173
GLY A 219
ARG A 225
SER A 226
 None
 1.27A 6clxA-1d0nA:
undetectable		 6clxA-1d0nA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d0n HORSE PLASMA
GELSOLIN

(Equus caballus) 		PF00626
(Gelsolin) 		5 ASP A 192
GLY A 219
ARG A 225
SER A 226
ASP A  61
 None
 0.99A 6clxA-1d0nA:
undetectable		 6clxA-1d0nA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hxj BETA-GLUCOSIDASE

(Zea mays) 		PF00232
(Glyco_hydro_1) 		5 TRP A  48
GLY A 463
GLY A  62
SER A  65
TRP A 460
 None
 1.30A 6clxA-1hxjA:
undetectable		 6clxA-1hxjA:
19.49
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.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLY A 643
GLY A 819
SER A 825
PHE A 676
ASP A 671
 None
 1.30A 6clxA-1kcwA:
undetectable		 6clxA-1kcwA:
15.77
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.
1kng THIOL:DISULFIDE
INTERCHANGE PROTEIN
CYCY

(Bradyrhizobium
japonicum) 		PF08534
(Redoxin) 		5 ALA A 147
GLY A 115
GLY A 140
ARG A 138
VAL A  87
 None
 1.26A 6clxA-1kngA:
undetectable		 6clxA-1kngA:
21.29
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.
1ltz PHENYLALANINE-4-HYDR
OXYLASE

(Chromobacterium
violaceum) 		PF00351
(Biopterin_H) 		5 ASP A 139
ARG A 123
GLY A 200
GLY A 142
PHE A 185
 HBI  A 500 ( 4.9A)
None
None
None
None
 1.31A 6clxA-1ltzA:
undetectable		 6clxA-1ltzA:
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.
1ooe DIHYDROPTERIDINE
REDUCTASE

(Caenorhabditis
elegans) 		PF00106
(adh_short) 		5 ALA A 149
GLY A 142
GLY A 144
SER A  87
PHE A  93
 None
 1.21A 6clxA-1ooeA:
4.8		 6clxA-1ooeA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p4m RIBOFLAVIN KINASE

(Homo sapiens) 		PF01687
(Flavokinase) 		5 ARG A 136
ALA A 133
GLY A 128
SER A 121
PHE A 116
 None
None
None
None
FMN  A 401 (-4.5A)
 1.28A 6clxA-1p4mA:
undetectable		 6clxA-1p4mA:
15.90
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.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 2

(Streptomyces
coelicolor) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ASP B 166
ALA B 105
GLY B 338
GLY B 164
ASP B 297
 None
 1.04A 6clxA-1tqyB:
undetectable		 6clxA-1tqyB:
25.41
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.
1ukc ESTA

(Aspergillus
niger) 		PF00135
(COesterase) 		5 GLY A 396
SER A 210
PHE A 240
ASP A 300
TRP A 301
 None
EDO  A1902 (-2.4A)
EDO  A1902 ( 4.5A)
None
None
 1.22A 6clxA-1ukcA:
undetectable		 6clxA-1ukcA:
21.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w5d PENICILLIN-BINDING
PROTEIN

(Bacillus
subtilis) 		PF02113
(Peptidase_S13) 		5 ASP A 128
ARG A 136
ALA A 246
GLY A  97
GLY A  95
 None
 1.29A 6clxA-1w5dA:
undetectable		 6clxA-1w5dA:
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.
1yni SUCCINYLARGININE
DIHYDROLASE

(Escherichia
coli) 		PF04996
(AstB) 		5 ARG A  30
ALA A  27
GLY A  24
SER A 207
VAL A 300
 None
 1.31A 6clxA-1yniA:
undetectable		 6clxA-1yniA:
25.90
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.
2cn3 BETA-1,4-XYLOGLUCAN
HYDROLASE

(Ruminiclostridium
thermocellum) 		PF02012
(BNR) 		5 GLY A 483
GLY A 504
PHE A 484
VAL A 498
TRP A 392
 None
 1.23A 6clxA-2cn3A:
undetectable		 6clxA-2cn3A:
18.23
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.
2cn3 BETA-1,4-XYLOGLUCAN
HYDROLASE

(Ruminiclostridium
thermocellum) 		PF02012
(BNR) 		5 TRP A 541
ALA A 733
GLY A 504
GLY A 506
VAL A 462
 None
 1.29A 6clxA-2cn3A:
undetectable		 6clxA-2cn3A:
18.23
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.
2cu0 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF00478
(IMPDH)
PF00571
(CBS) 		5 ASP A 342
ALA A 351
GLY A 335
ARG A 338
VAL A 293
 None
None
XMP  A1001 (-3.4A)
None
None
 1.30A 6clxA-2cu0A:
undetectable		 6clxA-2cu0A:
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.
2e8y AMYX PROTEIN

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 ASP A 666
ALA A 699
GLY A 704
GLY A 702
VAL A 706
 None
 1.24A 6clxA-2e8yA:
undetectable		 6clxA-2e8yA:
19.78
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.
2eyq TRANSCRIPTION-REPAIR
COUPLING FACTOR

(Escherichia
coli) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02559
(CarD_CdnL_TRCF)
PF03461
(TRCF) 		5 ALA A 880
GLY A 901
GLY A 904
ARG A 782
PHE A 943
 None
None
None
EPE  A1152 (-2.5A)
None
 1.20A 6clxA-2eyqA:
2.9		 6clxA-2eyqA:
17.33
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.
2i5i UPF0249 PROTEIN
EF_3048

(Enterococcus
faecalis) 		PF04794
(YdjC) 		5 ASP A  12
ALA A  47
GLY A  22
ARG A 231
ASP A 218
 None
 1.00A 6clxA-2i5iA:
undetectable		 6clxA-2i5iA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ipi ACLACINOMYCIN
OXIDOREDUCTASE
(AKNOX)

(Streptomyces
galilaeus) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ASP A 156
GLY A 382
GLY A 152
ARG A 397
SER A 399
 None
 1.20A 6clxA-2ipiA:
undetectable		 6clxA-2ipiA:
23.99
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.
2iy9 SUBA

(Escherichia
coli) 		PF00082
(Peptidase_S8) 		5 ASP A 184
ALA A 220
GLY A 182
VAL A 218
TRP A 246
 None
 1.26A 6clxA-2iy9A:
undetectable		 6clxA-2iy9A:
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.
2iyo 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING

(Lactococcus
lactis) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 ASP A  99
GLY A 178
GLY A 124
ARG A 111
VAL A 183
 None
 1.23A 6clxA-2iyoA:
7.3		 6clxA-2iyoA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o2c GLUCOSE-6-PHOSPHATE
ISOMERASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00342
(PGI) 		5 ARG A 326
SER A 131
PHE A 128
VAL A 550
ASP A 560
 G6Q  A5001 (-3.9A)
None
None
None
None
 1.28A 6clxA-2o2cA:
2.7		 6clxA-2o2cA:
21.83
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.
2p4e PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		no annotation 5 ASP P 129
ALA P 134
GLY P  76
GLY P 128
VAL P 124
 None
 1.29A 6clxA-2p4eP:
undetectable		 6clxA-2p4eP:
23.00
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.
2qjc DIADENOSINE
TETRAPHOSPHATASE,
PUTATIVE

(Trypanosoma
brucei) 		PF00149
(Metallophos) 		5 ASP A  26
ALA A 140
GLY A 220
GLY A 203
VAL A 200
 MN  A 400 (-3.3A)
None
None
None
None
 1.31A 6clxA-2qjcA:
undetectable		 6clxA-2qjcA:
25.61
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.
2r01 NITROREDUCTASE
FAMILY PROTEIN

(Chlorobaculum
tepidum) 		PF00881
(Nitroreductase) 		5 TRP A  77
ALA A 117
GLY A 131
ARG A  25
PHE A  27
 None
None
None
FMN  A 212 (-3.8A)
None
 1.25A 6clxA-2r01A:
undetectable		 6clxA-2r01A:
23.26
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.
2ybq METHYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00590
(TP_methylase) 		5 ALA A 134
GLY A  24
GLY A 103
ARG A 100
VAL A 132
 SAH  A1267 (-3.2A)
None
SAH  A1267 (-4.8A)
None
None
 1.25A 6clxA-2ybqA:
2.4		 6clxA-2ybqA:
25.84
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.
2zxq ENDO-ALPHA-N-ACETYLG
ALACTOSAMINIDASE

(Bifidobacterium
longum) 		PF12905
(Glyco_hydro_101)
PF17451
(Glyco_hyd_101C) 		5 ARG A 979
ALA A 879
GLY A 996
VAL A 992
TRP A1030
 None
 1.21A 6clxA-2zxqA:
undetectable		 6clxA-2zxqA:
15.51
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.
3ctm CARBONYL REDUCTASE

(Candida
parapsilosis) 		PF13561
(adh_short_C2) 		5 ASP A 222
ALA A  49
GLY A  41
GLY A  44
VAL A  39
 None
 1.30A 6clxA-3ctmA:
6.0		 6clxA-3ctmA:
20.42
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.
3dmy PROTEIN FDRA

(Escherichia
coli) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 ASP A 416
ALA A 344
GLY A 379
GLY A 339
ARG A 397
 None
 1.07A 6clxA-3dmyA:
2.9		 6clxA-3dmyA:
24.10
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.
3ed4 ARYLSULFATASE

(Escherichia
coli) 		PF00884
(Sulfatase) 		5 ALA A  86
GLY A 352
GLY A 321
ARG A 345
TRP A 350
 None
 1.02A 6clxA-3ed4A:
undetectable		 6clxA-3ed4A:
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.
3gbd SUCROSE ISOMERASE
SMUA FROM
PROTAMINOBACTER
RUBRUM

(Serratia
plymuthica) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ASP A 282
ALA A 291
GLY A 329
GLY A 332
VAL A 324
 None
 1.13A 6clxA-3gbdA:
undetectable		 6clxA-3gbdA:
20.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gxo MMCR

(Streptomyces
lavendulae) 		PF00891
(Methyltransf_2) 		7 TRP A 146
GLY A 190
GLY A 192
ARG A 214
PHE A 241
ASP A 260
TRP A 261
 SAH  A 350 ( 4.0A)
SAH  A 350 (-4.1A)
SAH  A 350 (-3.6A)
SAH  A 350 (-4.1A)
SAH  A 350 (-3.6A)
MQA  A 351 (-2.8A)
None
 0.78A 6clxA-3gxoA:
16.4		 6clxA-3gxoA:
39.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gxo MMCR

(Streptomyces
lavendulae) 		PF00891
(Methyltransf_2) 		5 TRP A 146
GLY A 191
PHE A 241
ASP A 260
TRP A 261
 SAH  A 350 ( 4.0A)
SAH  A 350 (-3.6A)
SAH  A 350 (-3.6A)
MQA  A 351 (-2.8A)
None
 0.76A 6clxA-3gxoA:
16.4		 6clxA-3gxoA:
39.49
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.
3h7t GROUP 3 ALLERGEN
SMIPP-S YVT004A06

(Sarcoptes
scabiei) 		PF00089
(Trypsin) 		5 ASP A 188
GLY A  17
GLY A  27
SER A  57
VAL A  20
 None
 1.09A 6clxA-3h7tA:
undetectable		 6clxA-3h7tA:
19.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3i58 O-METHYLTRANSFERASE

(Streptomyces
carzinostaticus) 		PF00891
(Methyltransf_2) 		7 TRP A 133
ASP A 147
GLY A 177
GLY A 179
SER A 227
PHE A 228
ASP A 247
 SAH  A 401 (-3.8A)
None
SAH  A 401 (-3.9A)
SAH  A 401 (-3.6A)
SAH  A 401 (-3.3A)
SAH  A 401 (-3.4A)
SAH  A 401 (-4.6A)
 0.72A 6clxA-3i58A:
32.3		 6clxA-3i58A:
39.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3i58 O-METHYLTRANSFERASE

(Streptomyces
carzinostaticus) 		PF00891
(Methyltransf_2) 		7 TRP A 133
GLY A 177
GLY A 179
SER A 227
PHE A 228
ASP A 247
TRP A 248
 SAH  A 401 (-3.8A)
SAH  A 401 (-3.9A)
SAH  A 401 (-3.6A)
SAH  A 401 (-3.3A)
SAH  A 401 (-3.4A)
SAH  A 401 (-4.6A)
None
 0.51A 6clxA-3i58A:
32.3		 6clxA-3i58A:
39.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3i58 O-METHYLTRANSFERASE

(Streptomyces
carzinostaticus) 		PF00891
(Methyltransf_2) 		6 TRP A 133
GLY A 178
SER A 227
PHE A 228
ASP A 247
TRP A 248
 SAH  A 401 (-3.8A)
SAH  A 401 (-3.6A)
SAH  A 401 (-3.3A)
SAH  A 401 (-3.4A)
SAH  A 401 (-4.6A)
None
 0.69A 6clxA-3i58A:
32.3		 6clxA-3i58A:
39.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ij3 CYTOSOL
AMINOPEPTIDASE

(Coxiella
burnetii) 		PF00883
(Peptidase_M17) 		5 GLY A  67
SER A  74
PHE A  77
VAL A  64
ASP A  95
 None
 1.18A 6clxA-3ij3A:
undetectable		 6clxA-3ij3A:
25.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lst CALO1
METHYLTRANSFERASE

(Micromonospora
echinospora) 		PF00891
(Methyltransf_2) 		5 GLY A 189
GLY A 191
ARG A 213
PHE A 238
TRP A 257
 SAH  A 346 (-4.0A)
SAH  A 346 ( 3.7A)
SAH  A 346 (-3.4A)
SAH  A 346 (-3.4A)
None
 0.50A 6clxA-3lstA:
19.2		 6clxA-3lstA:
35.00
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.
3mca ELONGATION FACTOR 1
ALPHA-LIKE PROTEIN
PROTEIN DOM34

(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03463
(eRF1_1)
PF03464
(eRF1_2)
PF03465
(eRF1_3) 		5 ASP B 357
ALA B 363
GLY A 514
SER A 554
ASP B 378
 None
 1.30A 6clxA-3mcaB:
undetectable		 6clxA-3mcaB:
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.
3n6z PUTATIVE
IMMUNOGLOBULIN A1
PROTEASE

(Bacteroides
ovatus) 		no annotation 5 ALA A 263
GLY A 270
GLY A 239
SER A 286
VAL A 301
 None
 1.31A 6clxA-3n6zA:
undetectable		 6clxA-3n6zA:
22.95
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.
3oqh PUTATIVE
UNCHARACTERIZED
PROTEIN YVMC

(Bacillus
licheniformis) 		PF16715
(CDPS) 		5 ASP A 113
ARG A  97
ALA A 100
PHE A 187
ASP A 119
 None
 1.12A 6clxA-3oqhA:
undetectable		 6clxA-3oqhA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pl1 PYRAZINAMIDASE/NICOT
INAMIDASE PNCA
(PZASE)

(Mycobacterium
tuberculosis) 		PF00857
(Isochorismatase) 		5 TRP A  68
ARG A 140
ALA A 171
PHE A  13
VAL A 139
 None
 1.23A 6clxA-3pl1A:
undetectable		 6clxA-3pl1A:
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.
3vqr PUTATIVE
OXIDOREDUCTASE

(Aeropyrum
pernix) 		PF01266
(DAO) 		5 ALA A  35
GLY A  12
GLY A  10
SER A 384
ASP A  43
 FAD  A1001 (-3.7A)
FAD  A1001 (-3.4A)
FAD  A1001 (-3.4A)
None
ACT  A1002 ( 3.1A)
 1.20A 6clxA-3vqrA:
undetectable		 6clxA-3vqrA:
28.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w0l GLUCOKINASE
REGULATORY PROTEIN

(Xenopus laevis) 		no annotation 5 GLY B 361
GLY B 341
SER B 387
PHE B 362
VAL B 359
 None
 1.29A 6clxA-3w0lB:
undetectable		 6clxA-3w0lB:
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.
3wh7 BETA-GLUCOSIDASE

(metagenomes) 		PF00232
(Glyco_hydro_1) 		5 ASP A 279
ALA A 285
GLY A 200
ARG A 137
SER A 136
 None
 1.26A 6clxA-3wh7A:
undetectable		 6clxA-3wh7A:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ze7 PERIPLASMIC [NIFESE]
HYDROGENASE, LARGE
SUBUNIT,
SELENOCYSTEINE-CONTA
INING

(Desulfovibrio
vulgaris) 		PF00374
(NiFeSe_Hases) 		5 ASP B 234
ALA B 367
GLY B 229
ARG B 149
VAL B 376
 None
 1.06A 6clxA-3ze7B:
undetectable		 6clxA-3ze7B:
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.
3zpy ALGINATE LYASE,
FAMILY PL7

(Zobellia
galactanivorans) 		PF08787
(Alginate_lyase2) 		5 TRP A 213
GLY A 418
GLY A 320
PHE A 258
VAL A 301
 None
 1.24A 6clxA-3zpyA:
undetectable		 6clxA-3zpyA:
19.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyv AOX3

(Mus musculus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 ASP A1089
ALA A1022
GLY A1083
GLY A1087
VAL A1080
 None
None
MTE  A3003 (-3.6A)
MTE  A3003 (-2.8A)
None
 1.19A 6clxA-3zyvA:
undetectable		 6clxA-3zyvA:
14.01
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.
4a6e HYDROXYINDOLE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		5 GLY A 187
GLY A 189
PHE A 237
ASP A 256
TRP A 257
 SAM  A1349 (-3.6A)
SAM  A1349 ( 3.8A)
SAM  A1349 (-3.5A)
ASE  A1350 ( 2.9A)
None
 0.64A 6clxA-4a6eA:
32.5		 6clxA-4a6eA:
28.65
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.
4bhy ALANINE RACEMASE

(Aeromonas
hydrophila) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 ASP A 303
GLY A 276
GLY A 272
ARG A 351
SER A 350
 None
 1.30A 6clxA-4bhyA:
undetectable		 6clxA-4bhyA:
25.67
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.
4cze ROD
SHAPE-DETERMINING
PROTEIN MREB

(Caulobacter
vibrioides) 		PF06723
(MreB_Mbl) 		5 GLY A 165
GLY A 188
ARG A  72
SER A  37
ASP A  76
 PO4  A1334 (-3.7A)
None
None
None
None
 1.30A 6clxA-4czeA:
undetectable		 6clxA-4czeA:
24.88
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.
4fu0 D-ALANINE--D-ALANINE
LIGASE 7

(Enterococcus
faecalis) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		5 ASP A 299
ALA A 283
GLY A 228
SER A 323
VAL A 239
 None
 1.28A 6clxA-4fu0A:
undetectable		 6clxA-4fu0A:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4grw NANOBODY 22E11

(Lama glama) 		PF07686
(V-set) 		5 ALA H  24
GLY H  35
GLY H  97
SER H 105
VAL H  79
 None
 1.30A 6clxA-4grwH:
undetectable		 6clxA-4grwH:
15.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ix2 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Vibrio cholerae) 		PF00478
(IMPDH) 		5 ASP A 348
ALA A 357
GLY A 341
ARG A 344
VAL A 299
 None
None
IMP  A 501 ( 3.8A)
None
None
 1.27A 6clxA-4ix2A:
undetectable		 6clxA-4ix2A:
26.72
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.
4jn7 ENOLASE

(Agrobacterium
tumefaciens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ASP A  13
GLY A 296
ARG A 319
VAL A 302
ASP A 265
 None
 1.26A 6clxA-4jn7A:
undetectable		 6clxA-4jn7A:
23.65
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.
4joq ABC RIBOSE
TRANSPORTER,
PERIPLASMIC
SOLUTE-BINDING
PROTEIN

(Rhodobacter
sphaeroides) 		PF13407
(Peripla_BP_4) 		5 ASP A 225
ARG A 174
ALA A 222
GLY A 250
VAL A 269
 None
ACT  A 401 (-3.1A)
None
None
None
 1.12A 6clxA-4joqA:
undetectable		 6clxA-4joqA:
24.60
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.
4kg7 PEPTIDASE S8 AND
S53, SUBTILISIN,
KEXIN, SEDOLISIN

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		5 ALA A 131
GLY A 119
GLY A  97
SER A 116
VAL A 107
 None
 1.08A 6clxA-4kg7A:
undetectable		 6clxA-4kg7A:
23.88
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.
4lds BICYCLOMYCIN
RESISTANCE PROTEIN
TCAB

(Staphylococcus
epidermidis) 		PF00083
(Sugar_tr) 		5 TRP A 160
ALA A 108
GLY A 101
GLY A  85
SER A  92
 None
 1.18A 6clxA-4ldsA:
undetectable		 6clxA-4ldsA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ne9 PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF05922
(Inhibitor_I9) 		5 ASP C 129
ALA C 134
GLY C  76
GLY C 128
VAL C 124
 None
 1.23A 6clxA-4ne9C:
undetectable		 6clxA-4ne9C:
21.25
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.
4nq3 CYANURIC ACID
AMIDOHYDROLASE

(Azorhizobium
caulinodans) 		PF09663
(Amido_AtzD_TrzD) 		5 ASP A  49
GLY A  39
GLY A  80
PHE A  90
VAL A  77
 None
None
BR8  A 401 (-3.2A)
None
None
 1.31A 6clxA-4nq3A:
undetectable		 6clxA-4nq3A:
25.99
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.
4p22 UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME 1

(Homo sapiens) 		PF00899
(ThiF)
PF16190
(E1_FCCH)
PF16191
(E1_4HB) 		5 ALA A 405
GLY A  79
GLY A  84
ARG A  81
VAL A 163
 None
 1.10A 6clxA-4p22A:
5.2		 6clxA-4p22A:
22.27
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.
4qs9 HEXOKINASE-1

(Arabidopsis
thaliana) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		5 ALA A 248
GLY A 481
GLY A 237
VAL A 232
ASP A 101
 None
 1.18A 6clxA-4qs9A:
undetectable		 6clxA-4qs9A:
22.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ru1 MONOSACCHARIDE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, CUT2 FAMILY

(Acidothermus
cellulolyticus) 		PF13407
(Peripla_BP_4) 		5 ASP A 279
ARG A 190
ALA A 159
GLY A 153
GLY A 312
 None
INS  A 401 (-2.6A)
None
None
None
 0.97A 6clxA-4ru1A:
2.2		 6clxA-4ru1A:
23.26
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.
4u4p STRUCTURAL
MAINTENANCE OF
CHROMOSOMES PROTEIN
2

(Homo sapiens) 		PF06470
(SMC_hinge) 		5 ASP A 555
ALA A 619
GLY A 524
PHE A 508
VAL A 526
 None
 1.27A 6clxA-4u4pA:
undetectable		 6clxA-4u4pA:
21.68
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.
4u9i PERIPLASMIC [NIFE]
HYDROGENASE SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 ASP S 135
ALA S 144
GLY S  77
GLY S 132
VAL S  74
 None
 1.29A 6clxA-4u9iS:
undetectable		 6clxA-4u9iS:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4umf 3-DEOXY-D-MANNO-OCTU
LOSONATE 8-PHOSPHATE
PHOSPHATASE KDSC

(Moraxella
catarrhalis) 		PF00702
(Hydrolase) 		5 ASP A  43
ALA A  38
GLY A  20
GLY A 147
SER A 126
 None
None
MG  A1175 ( 4.7A)
None
None
 1.27A 6clxA-4umfA:
2.7		 6clxA-4umfA:
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.
4xyb FORMATE
DEHYDROGENASE

(Granulicella
mallensis) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 ALA A 222
GLY A 204
GLY A 201
ARG A 209
VAL A 198
 NDP  A 401 (-3.4A)
None
NDP  A 401 (-3.5A)
None
None
 1.25A 6clxA-4xybA:
undetectable		 6clxA-4xybA:
23.88
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.
4yqy PUTATIVE
DEHYDROGENASE

(Sulfitobacter
sp. NAS-14.1) 		PF13561
(adh_short_C2) 		5 ASP A  16
ALA A 220
GLY A  12
GLY A  18
VAL A  88
 None
 1.27A 6clxA-4yqyA:
6.2		 6clxA-4yqyA:
27.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4z2y CALO6

(Micromonospora
echinospora) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		5 ALA A 188
GLY A 183
GLY A 185
PHE A 234
ASP A 253
 None
 1.00A 6clxA-4z2yA:
25.0		 6clxA-4z2yA:
39.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zfm PUTATIVE
6-PHOSPHO-BETA-GALAC
TOBIOSIDASE

(Geobacillus
stearothermophilus) 		PF00232
(Glyco_hydro_1) 		5 ASP A 284
ALA A 291
ARG A 141
SER A 140
VAL A 208
 None
 1.18A 6clxA-4zfmA:
undetectable		 6clxA-4zfmA:
23.12
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
GAMMA

(Methanothermobacter
marburgensis) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 ALA B 328
GLY B 373
GLY B 371
VAL B 393
ASP B 400
 None
 1.23A 6clxA-5a8rB:
undetectable		 6clxA-5a8rB:
22.50
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.
5ahm INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00478
(IMPDH) 		5 ASP A 345
ALA A 354
GLY A 338
ARG A 341
VAL A 296
 None
None
IMP  A 501 (-3.6A)
None
None
 1.29A 6clxA-5ahmA:
undetectable		 6clxA-5ahmA:
27.87
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.
5ayn SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER)

(Bdellovibrio
bacteriovorus) 		PF06963
(FPN1) 		5 ARG A  17
GLY A 129
GLY A  80
SER A 122
ASP A  24
 None
None
None
None
K  A 501 (-3.3A)
 1.22A 6clxA-5aynA:
undetectable		 6clxA-5aynA:
24.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cef ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Cryptococcus
neoformans) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 ALA A 348
GLY A  13
GLY A  19
SER A  40
ASP A  90
 None
 1.14A 6clxA-5cefA:
3.6		 6clxA-5cefA:
22.60
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.
5cvv (ISO)EUGENOL
O-METHYLTRANSFERASE

(Clarkia breweri) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		5 TRP A 166
GLY A 211
GLY A 213
ASP A 273
TRP A 274
 SAH  A 401 ( 3.6A)
SAH  A 401 (-3.8A)
SAH  A 401 ( 3.7A)
N7I  A 402 ( 2.7A)
None
 0.76A 6clxA-5cvvA:
24.0		 6clxA-5cvvA:
28.50
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.
5er3 SUGAR ABC
TRANSPORTER,
PERIPLASMIC
SUGAR-BINDING
PROTEIN

(Rhodopirellula
baltica) 		PF13407
(Peripla_BP_4) 		5 ASP A 117
GLY A  89
GLY A 115
ARG A 346
SER A 347
 None
 1.23A 6clxA-5er3A:
3.1		 6clxA-5er3A:
24.41
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.
5ey7 FRUCTOKINASE

(Vibrio cholerae) 		PF00294
(PfkB) 		5 ARG A 176
GLY A  25
SER A  61
VAL A  28
ASP A 266
 None
 1.09A 6clxA-5ey7A:
4.4		 6clxA-5ey7A:
23.90
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.
5fac ALANINE RACEMASE

(Streptomyces
coelicolor) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 ASP A 332
GLY A 305
GLY A 301
ARG A 383
SER A 382
 None
 1.20A 6clxA-5facA:
undetectable		 6clxA-5facA:
28.84
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.
5faf GELSOLIN

(Homo sapiens) 		PF00626
(Gelsolin) 		5 ASP A 192
ALA A 173
GLY A 219
ARG A 225
SER A 226
 None
None
GOL  A 302 (-3.3A)
None
None
 1.12A 6clxA-5fafA:
undetectable		 6clxA-5fafA:
16.30
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.
5i2h O-METHYLTRANSFERASE
FAMILY 2

(Planctopirus
limnophila) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		5 ALA A 166
GLY A 202
ARG A 225
ASP A 271
TRP A 272
 None
None
None
AGI  A 501 (-2.4A)
None
 1.30A 6clxA-5i2hA:
22.1		 6clxA-5i2hA:
27.95
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.
5i2h O-METHYLTRANSFERASE
FAMILY 2

(Planctopirus
limnophila) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		5 ALA A 166
GLY A 203
ARG A 225
ASP A 271
TRP A 272
 None
None
None
AGI  A 501 (-2.4A)
None
 0.94A 6clxA-5i2hA:
22.1		 6clxA-5i2hA:
27.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jr3 CARMINOMYCIN
4-O-METHYLTRANSFERAS
E DNRK

(Streptomyces
peucetius) 		PF00891
(Methyltransf_2) 		5 ALA A 161
GLY A 187
GLY A 189
PHE A 238
TRP A 258
 None
SAH  A 401 (-3.9A)
SAH  A 401 ( 3.8A)
SAH  A 401 (-3.4A)
None
 1.17A 6clxA-5jr3A:
33.1		 6clxA-5jr3A:
38.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jr3 CARMINOMYCIN
4-O-METHYLTRANSFERAS
E DNRK

(Streptomyces
peucetius) 		PF00891
(Methyltransf_2) 		5 ASP A 157
GLY A 187
GLY A 189
PHE A 238
TRP A 258
 None
SAH  A 401 (-3.9A)
SAH  A 401 ( 3.8A)
SAH  A 401 (-3.4A)
None
 0.55A 6clxA-5jr3A:
33.1		 6clxA-5jr3A:
38.27
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.
5l44 K-26 DIPEPTIDYL
CARBOXYPEPTIDASE

(Astrosporangium
hypotensionis) 		PF01432
(Peptidase_M3) 		5 TRP A 136
ASP A 286
ALA A 289
ARG A 140
ASP A 646
 None
 1.30A 6clxA-5l44A:
undetectable		 6clxA-5l44A:
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.
5mz9 -

(-) 		no annotation 5 ALA A 201
GLY A 511
GLY A 204
PHE A 607
ASP A 519
 SLT  A1003 ( 4.4A)
None
None
None
None
 1.25A 6clxA-5mz9A:
undetectable		 6clxA-5mz9A:
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.
5mzv NANOBODY 22E11

(Lama glama) 		no annotation 5 ALA D  24
GLY D  35
GLY D  97
SER D 105
VAL D  79
 None
 1.27A 6clxA-5mzvD:
undetectable		 6clxA-5mzvD:
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.
5n1q METHYL-COENZYME M
REDUCTASE III FROM
METHANOTHERMOCOCCUS
THERMOLITHOTROPHICUS
SUBUNIT BETA

(Methanothermococcus
thermolithotrophicus) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 ALA B 328
GLY B 373
GLY B 371
VAL B 393
ASP B 400
 None
 1.15A 6clxA-5n1qB:
undetectable		 6clxA-5n1qB:
22.06
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.
5n28 METHYL-COENZYME M
REDUCTASE, BETA
SUBUNIT

(Methanotorris
formicicus) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 ALA B 329
GLY B 374
GLY B 372
VAL B 394
ASP B 401
 None
 1.17A 6clxA-5n28B:
undetectable		 6clxA-5n28B:
22.54
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.
5v9x ATP-DEPENDENT DNA
HELICASE

(Mycolicibacterium
smegmatis) 		no annotation 5 ASP A 715
ALA A 712
GLY A 603
GLY A 685
SER A 384
 None
 1.30A 6clxA-5v9xA:
3.1		 6clxA-5v9xA:
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.
5vlh PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8)
PF05922
(Inhibitor_I9) 		5 ASP A 129
ALA A 134
GLY A  76
GLY A 128
VAL A 124
 None
 1.28A 6clxA-5vlhA:
undetectable		 6clxA-5vlhA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w8q BIS3 BIPHENYL
SYNTHASE

(Malus domestica) 		no annotation 5 TRP A 292
ASP A 286
ALA A 236
GLY A 365
PHE A 297
 None
 1.24A 6clxA-5w8qA:
undetectable		 6clxA-5w8qA:
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.
5wyh INTERAPTIN

(Legionella
pneumophila) 		no annotation 5 ALA B 112
GLY B 160
GLY B 180
VAL B 158
ASP B  47
 None
 1.30A 6clxA-5wyhB:
undetectable		 6clxA-5wyhB:
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.
5xnz CRED

(Streptomyces
cremeus) 		no annotation 5 ASP A 131
ARG A 349
ALA A 348
GLY A 127
VAL A  16
 None
 1.03A 6clxA-5xnzA:
undetectable		 6clxA-5xnzA:
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.
5yq0 COFJ

(Escherichia
coli) 		no annotation 5 TRP A 244
ALA A  78
GLY A  59
SER A 300
ASP A 206
 None
 1.23A 6clxA-5yq0A:
undetectable		 6clxA-5yq0A:
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.
6ane POLY(ETHYLENE
TEREPHTHALATE)
HYDROLASE

(Ideonella
sakaiensis) 		no annotation 5 ALA A 213
GLY A 136
GLY A 131
ARG A  96
TRP A 158
 None
 1.22A 6clxA-6aneA:
undetectable		 6clxA-6aneA:
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.
6c5b METHYLTRANSFERASE

(Lysobacter
antibioticus) 		no annotation 6 ALA A 156
GLY A 182
GLY A 184
PHE A 233
ASP A 252
TRP A 253
 None
SAH  A 501 (-4.0A)
SAH  A 501 (-3.3A)
SAH  A 501 (-3.5A)
SAH  A 501 (-4.0A)
None
 1.00A 6clxA-6c5bA:
32.0		 6clxA-6c5bA:
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.
6ej2 BETA-SECRETASE 1

(Homo sapiens) 		no annotation 5 ARG A 758
ALA A 757
GLY A 586
SER A 407
PHE A 408
 None
 1.23A 6clxA-6ej2A:
undetectable		 6clxA-6ej2A:
undetectable