SIMILAR PATTERNS OF AMINO ACIDS FOR 3W68_C_VIVC301

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.
1a3x PYRUVATE KINASE

(Saccharomyces
cerevisiae) 		PF00224
(PK)
PF02887
(PK_C) 		5 ILE A 215
ILE A 224
VAL A 227
LEU A 228
VAL A 203
 None
 0.80A 3w68C-1a3xA:
0.1		 3w68C-1a3xA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bvu PROTEIN (GLUTAMATE
DEHYDROGENASE)

(Thermococcus
litoralis) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 VAL A 401
ILE A 312
ILE A 337
LEU A 341
VAL A  95
 None
 1.15A 3w68C-1bvuA:
undetectable		 3w68C-1bvuA:
21.24
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.
1c2r CYTOCHROME C2

(Rhodobacter
capsulatus) 		no annotation 5 ILE A  57
LEU A 100
ILE A  72
VAL A 107
LEU A 111
 HEM  A 120 (-4.2A)
HEM  A 120 ( 4.2A)
HEM  A 120 ( 4.7A)
None
None
 1.06A 3w68C-1c2rA:
undetectable		 3w68C-1c2rA:
17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1euz GLUTAMATE
DEHYDROGENASE

(Thermococcus
profundus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 VAL A 402
ILE A 313
ILE A 338
LEU A 342
VAL A  96
 None
 1.26A 3w68C-1euzA:
0.0		 3w68C-1euzA:
20.43
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.
1f5a POLY(A) POLYMERASE

(Bos taurus) 		PF01909
(NTP_transf_2)
PF04926
(PAP_RNA-bind)
PF04928
(PAP_central) 		5 VAL A 247
LEU A 252
ILE A 316
VAL A 285
LEU A 286
 3AT  A1000 (-3.9A)
None
None
None
None
 1.25A 3w68C-1f5aA:
0.0		 3w68C-1f5aA:
20.54
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.
1g1a DTDP-D-GLUCOSE
4,6-DEHYDRATASE

(Salmonella
enterica) 		PF16363
(GDP_Man_Dehyd) 		5 ILE A  68
VAL A 110
LEU A 187
ILE A  59
VAL A 247
 None
None
None
NAD  A 400 (-3.7A)
None
 1.19A 3w68C-1g1aA:
0.0		 3w68C-1g1aA:
21.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gtm GLUTAMATE
DEHYDROGENASE

(Pyrococcus
furiosus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 VAL A 402
ILE A 313
ILE A 338
LEU A 342
VAL A  95
 None
 1.21A 3w68C-1gtmA:
undetectable		 3w68C-1gtmA:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hqm DNA-DIRECTED RNA
POLYMERASE SUBUNIT
ALPHA

(Thermus
aquaticus) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		5 VAL A 143
ILE A  68
ILE A  78
LEU A  82
VAL A  53
 None
 1.26A 3w68C-1hqmA:
undetectable		 3w68C-1hqmA:
22.42
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.
1hr7 MITOCHONDRIAL
PROCESSING PEPTIDASE
BETA SUBUNIT

(Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 LEU B 380
VAL B 275
ILE B 368
ILE B 426
PHE B 283
 None
 1.24A 3w68C-1hr7B:
0.4		 3w68C-1hr7B:
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.
1ii0 ARSENICAL
PUMP-DRIVING ATPASE

(Escherichia
coli) 		PF02374
(ArsA_ATPase) 		5 ILE A   7
ILE A 140
VAL A  42
LEU A  41
VAL A  50
 None
 0.97A 3w68C-1ii0A:
undetectable		 3w68C-1ii0A:
18.96
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.
1ii0 ARSENICAL
PUMP-DRIVING ATPASE

(Escherichia
coli) 		PF02374
(ArsA_ATPase) 		5 VAL A  53
ILE A   7
ILE A 140
LEU A  41
VAL A  50
 None
 1.27A 3w68C-1ii0A:
undetectable		 3w68C-1ii0A:
18.96
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.
1ii0 ARSENICAL
PUMP-DRIVING ATPASE

(Escherichia
coli) 		PF02374
(ArsA_ATPase) 		5 VAL A 202
ILE A   7
ILE A 140
LEU A  41
VAL A  50
 None
 0.71A 3w68C-1ii0A:
undetectable		 3w68C-1ii0A:
18.96
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.
1jqe HISTAMINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF13489
(Methyltransf_23) 		5 ILE A 142
ILE A  70
VAL A  74
LEU A  71
VAL A 111
 SAH  A 400 (-4.1A)
None
None
None
None
 0.96A 3w68C-1jqeA:
undetectable		 3w68C-1jqeA:
21.50
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.
1k6m 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
PHOSPHATASE
2-PHOSPHATASE

(Homo sapiens) 		PF00300
(His_Phos_1)
PF01591
(6PF2K) 		5 ILE A 290
VAL A 421
ILE A 253
LEU A 381
VAL A 377
 None
 1.08A 3w68C-1k6mA:
undetectable		 3w68C-1k6mA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ktw IOTA-CARRAGEENASE

(Alteromonas sp.
ATCC 43554) 		PF12708
(Pectate_lyase_3) 		5 VAL A 135
ILE A 209
ILE A 187
LEU A 164
VAL A 167
 None
 1.03A 3w68C-1ktwA:
undetectable		 3w68C-1ktwA:
19.86
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.
1lbz FRUCTOSE
1,6-BISPHOSPHATASE/I
NOSITOL
MONOPHOSPHATASE

(Archaeoglobus
fulgidus) 		PF00459
(Inositol_P) 		5 VAL A 117
VAL A  77
ILE A  13
LEU A  57
VAL A  62
 None
 1.17A 3w68C-1lbzA:
undetectable		 3w68C-1lbzA:
23.96
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.
1lc0 BILIVERDIN REDUCTASE
A

(Rattus
norvegicus) 		PF01408
(GFO_IDH_MocA)
PF09166
(Biliv-reduc_cat) 		5 ILE A 169
ILE A 277
VAL A  93
LEU A  94
PHE A  86
 None
 1.04A 3w68C-1lc0A:
undetectable		 3w68C-1lc0A:
22.12
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.
1nnh ASPARAGINYL-TRNA
SYNTHETASE-RELATED
PEPTIDE

(Pyrococcus
furiosus) 		PF00152
(tRNA-synt_2) 		5 LEU A  94
ILE A  21
VAL A 265
LEU A 268
VAL A 216
 None
 1.13A 3w68C-1nnhA:
undetectable		 3w68C-1nnhA:
24.04
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.
1q5n 3-CARBOXY-CIS,CIS-MU
CONATE
CYCLOISOMERASE

(Acinetobacter
calcoaceticus) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		5 VAL A 130
ILE A 116
ILE A 237
VAL A 240
LEU A 241
 None
 0.88A 3w68C-1q5nA:
undetectable		 3w68C-1q5nA:
20.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r5l PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		10 ILE A 119
TRP A 122
VAL A 132
PHE A 158
ILE A 171
ILE A 179
VAL A 182
LEU A 183
PHE A 187
VAL A 191
 None
None
VIV  A 301 ( 4.7A)
VIV  A 301 (-3.9A)
None
VIV  A 301 ( 4.0A)
VIV  A 301 (-4.5A)
None
VIV  A 301 (-3.9A)
VIV  A 301 (-4.7A)
 0.29A 3w68C-1r5lA:
37.3		 3w68C-1r5lA:
89.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r5l PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		5 ILE A 119
TRP A 122
VAL A 132
VAL A 191
PHE A 158
 None
None
VIV  A 301 ( 4.7A)
VIV  A 301 (-4.7A)
VIV  A 301 (-3.9A)
 1.16A 3w68C-1r5lA:
37.3		 3w68C-1r5lA:
89.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r5l PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		8 ILE A 119
VAL A 132
LEU A 137
PHE A 158
VAL A 182
LEU A 183
PHE A 187
VAL A 191
 None
VIV  A 301 ( 4.7A)
VIV  A 301 ( 4.8A)
VIV  A 301 (-3.9A)
VIV  A 301 (-4.5A)
None
VIV  A 301 (-3.9A)
VIV  A 301 (-4.7A)
 0.52A 3w68C-1r5lA:
37.3		 3w68C-1r5lA:
89.10
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.
1rk2 RIBOKINASE

(Escherichia
coli) 		PF00294
(PfkB) 		5 VAL A 240
ILE A 162
ILE A 183
LEU A 221
VAL A 229
 None
 0.98A 3w68C-1rk2A:
undetectable		 3w68C-1rk2A:
20.18
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.
1vl4 PMBA-RELATED PROTEIN

(Thermotoga
maritima) 		PF01523
(PmbA_TldD) 		6 VAL A 427
PHE A 400
ILE A 243
ILE A 270
VAL A 268
VAL A 425
 None
 1.36A 3w68C-1vl4A:
undetectable		 3w68C-1vl4A:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vmk PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermotoga
maritima) 		PF01048
(PNP_UDP_1) 		5 ILE A 130
LEU A 258
ILE A  25
LEU A  23
VAL A 103
 None
 1.23A 3w68C-1vmkA:
undetectable		 3w68C-1vmkA:
17.99
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.
1y8t HYPOTHETICAL PROTEIN
RV0983

(Mycobacterium
tuberculosis) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 ILE A 216
VAL A  19
ILE A  51
LEU A  22
VAL A  20
 None
 1.08A 3w68C-1y8tA:
undetectable		 3w68C-1y8tA:
22.66
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.
1ybd URIDYLATE KINASE

(Neisseria
meningitidis) 		PF00696
(AA_kinase) 		5 VAL A  55
VAL A  45
ILE A 220
LEU A 226
VAL A  44
 None
 1.22A 3w68C-1ybdA:
undetectable		 3w68C-1ybdA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ysj PROTEIN YXEP

(Bacillus
subtilis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 ILE A 108
VAL A  67
ILE A  74
VAL A 147
VAL A 151
 None
 0.93A 3w68C-1ysjA:
undetectable		 3w68C-1ysjA:
21.00
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.
2bvg 6-HYDROXY-D-NICOTINE
OXIDASE

(Paenarthrobacter
nicotinovorans) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ILE A 241
VAL A 259
PHE A 146
ILE A 288
VAL A 303
 None
 1.10A 3w68C-2bvgA:
undetectable		 3w68C-2bvgA:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d4w GLYCEROL KINASE

(Cellulomonas
sp.) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ILE A  73
VAL A  59
ILE A  78
LEU A 169
VAL A 180
 None
 1.12A 3w68C-2d4wA:
1.7		 3w68C-2d4wA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eq9 PYRUVATE
DEHYDROGENASE
COMPLEX,
DIHYDROLIPOAMIDE
DEHYDROGENASE E3
COMPONENT

(Thermus
thermophilus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 VAL A 272
VAL A 265
PHE A 157
LEU A 254
VAL A 263
 None
 1.16A 3w68C-2eq9A:
undetectable		 3w68C-2eq9A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f6k METAL-DEPENDENT
HYDROLASE

(Lactobacillus
plantarum) 		PF04909
(Amidohydro_2) 		5 VAL A 236
ILE A 185
LEU A 188
PHE A 192
VAL A 232
 None
 1.13A 3w68C-2f6kA:
2.1		 3w68C-2f6kA:
21.12
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.
2g4r MOLYBDOPTERIN
BIOSYNTHESIS MOG
PROTEIN

(Mycobacterium
tuberculosis) 		PF00994
(MoCF_biosynth) 		5 LEU A  32
ILE A  99
ILE A 126
VAL A  65
LEU A 124
 None
 0.97A 3w68C-2g4rA:
undetectable		 3w68C-2g4rA:
19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2him L-ASPARAGINASE 1

(Escherichia
coli) 		PF00710
(Asparaginase) 		5 ILE A 322
LEU A 257
ILE A 212
ILE A 238
VAL A 278
 None
 0.96A 3w68C-2himA:
undetectable		 3w68C-2himA:
20.68
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.
2hru PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE II

(Thermotoga
maritima) 		PF00586
(AIRS)
PF02769
(AIRS_C)
PF16904
(PurL_C) 		5 LEU A 306
VAL A 231
ILE A 219
LEU A 223
VAL A 226
 None
 1.07A 3w68C-2hruA:
undetectable		 3w68C-2hruA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jo7 GLYCOSYLPHOSPHATIDYL
INOSITOL-ANCHORED
MEROZOITE SURFACE
PROTEIN

(Babesia
divergens) 		PF11641
(Antigen_Bd37) 		5 LEU A 177
ILE A 157
ILE A  99
LEU A 102
VAL A 129
 None
 1.22A 3w68C-2jo7A:
undetectable		 3w68C-2jo7A:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2kko POSSIBLE
TRANSCRIPTIONAL
REGULATORY PROTEIN
(POSSIBLY
ARSR-FAMILY)

(Mycobacterium
bovis) 		PF12840
(HTH_20) 		5 VAL A  15
LEU A  22
VAL A  93
LEU A  92
PHE A  90
 None
 1.26A 3w68C-2kkoA:
undetectable		 3w68C-2kkoA:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o3j UDP-GLUCOSE
6-DEHYDROGENASE

(Caenorhabditis
elegans) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 ILE A 400
VAL A 417
LEU A 419
PHE A 444
VAL A 277
 None
 0.83A 3w68C-2o3jA:
undetectable		 3w68C-2o3jA:
18.63
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.
2pw9 PUTATIVE FORMATE
DEHYDROGENASE
ACCESSORY PROTEIN

(Desulfotalea
psychrophila) 		PF02634
(FdhD-NarQ) 		5 LEU A 201
VAL A 180
PHE A 136
ILE A 256
ILE A 216
 None
 1.15A 3w68C-2pw9A:
undetectable		 3w68C-2pw9A:
20.62
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.
2pzi PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNG

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase)
PF16918
(PknG_TPR)
PF16919
(PknG_rubred) 		5 ILE A 282
LEU A 340
VAL A 399
LEU A 369
VAL A 395
 None
 1.06A 3w68C-2pziA:
undetectable		 3w68C-2pziA:
16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v7g UROCANATE HYDRATASE

(Pseudomonas
putida) 		PF01175
(Urocanase)
PF17391
(Urocanase_N)
PF17392
(Urocanase_C) 		5 ILE A  12
VAL A  69
VAL A 505
LEU A 366
VAL A 439
 None
 1.18A 3w68C-2v7gA:
undetectable		 3w68C-2v7gA:
17.95
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.
2vwb PUTATIVE
O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE

(Methanocaldococcus
jannaschii) 		PF00814
(Peptidase_M22)
PF01163
(RIO1) 		5 LEU A 484
ILE A 425
ILE A 435
VAL A 439
VAL A 513
 None
 1.23A 3w68C-2vwbA:
undetectable		 3w68C-2vwbA:
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.
2wsm HYDROGENASE
EXPRESSION/FORMATION
PROTEIN (HYPB)

(Archaeoglobus
fulgidus) 		PF02492
(cobW) 		5 ILE A 191
VAL A 134
ILE A 211
LEU A 212
VAL A  58
 None
 1.08A 3w68C-2wsmA:
undetectable		 3w68C-2wsmA:
23.74
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.
2yne GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Plasmodium
vivax) 		PF01233
(NMT)
PF02799
(NMT_C) 		5 ILE A 144
ILE A 407
VAL A 405
LEU A 277
VAL A 206
 None
 1.23A 3w68C-2yneA:
undetectable		 3w68C-2yneA:
22.25
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.
2ywx PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT

(Methanocaldococcus
jannaschii) 		PF00731
(AIRC) 		5 LEU A  22
VAL A  80
ILE A 122
LEU A 118
VAL A 107
 None
 1.18A 3w68C-2ywxA:
undetectable		 3w68C-2ywxA:
20.22
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.
3b8a HEXOKINASE-1

(Saccharomyces
cerevisiae) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		5 ILE X 403
VAL X  36
ILE X  63
VAL X 279
LEU X 280
 None
 1.25A 3w68C-3b8aX:
undetectable		 3w68C-3b8aX:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		5 ILE A 495
VAL A 310
ILE A 435
LEU A 409
VAL A 303
 None
 1.04A 3w68C-3bolA:
undetectable		 3w68C-3bolA:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cmv PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 ILE A1225
ILE A1192
ILE A1190
VAL A1140
LEU A1188
 None
 0.98A 3w68C-3cmvA:
undetectable		 3w68C-3cmvA:
11.55
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.
3cmv PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 ILE A2225
ILE A2192
ILE A2190
VAL A2140
LEU A2188
 None
 1.00A 3w68C-3cmvA:
undetectable		 3w68C-3cmvA:
11.55
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.
3f70 LETHAL(3)MALIGNANT
BRAIN TUMOR-LIKE 2
PROTEIN

(Homo sapiens) 		PF02820
(MBT) 		5 ILE A 553
TRP A 593
ILE A 349
LEU A 355
VAL A 331
 None
 1.11A 3w68C-3f70A:
undetectable		 3w68C-3f70A:
19.57
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.
3fai BETA-LACTAMASE

(Aeromonas
hydrophila) 		PF00753
(Lactamase_B) 		5 ILE A 131
TRP A 128
VAL A 112
LEU A 182
ILE A  99
 None
None
None
GOL  A 318 (-4.6A)
None
 1.09A 3w68C-3faiA:
2.7		 3w68C-3faiA:
19.05
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.
3j7a 40S RIBOSOMAL
PROTEIN US10

(Plasmodium
falciparum) 		PF00338
(Ribosomal_S10) 		5 VAL N  34
VAL N  96
ILE N  88
VAL N  49
LEU N  90
 None
 1.20A 3w68C-3j7aN:
undetectable		 3w68C-3j7aN:
15.04
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.
3jxz ALKYLPURINE DNA
GLYCOSYLASE ALKD

(Bacillus cereus) 		PF08713
(DNA_alkylation) 		5 VAL A 199
ILE A 185
VAL A 188
LEU A 189
VAL A 200
 None
 1.01A 3w68C-3jxzA:
undetectable		 3w68C-3jxzA:
23.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o80 HEXOKINASE

(Kluyveromyces
lactis) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		5 ILE A 402
VAL A  36
ILE A  63
VAL A 278
LEU A 279
 None
ANP  A 487 (-4.4A)
None
None
None
 1.19A 3w68C-3o80A:
undetectable		 3w68C-3o80A:
21.14
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.
3p8t ASNS-LIKE
ASPARAGINYL-TRNA
SYNTHETASE RELATED
PROTEIN

(Pyrococcus
abyssi) 		PF00152
(tRNA-synt_2) 		5 LEU A  94
ILE A  21
VAL A 265
LEU A 268
VAL A 216
 None
 1.21A 3w68C-3p8tA:
undetectable		 3w68C-3p8tA:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rh9 SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE
(NAD(P)(+))

(Marinobacter
hydrocarbonoclasticus) 		PF00171
(Aldedh) 		5 VAL A 148
ILE A 215
VAL A 218
LEU A 219
VAL A 225
 None
 0.98A 3w68C-3rh9A:
undetectable		 3w68C-3rh9A:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sd7 PUTATIVE PHOSPHATASE

(Clostridioides
difficile) 		PF13419
(HAD_2) 		5 VAL A 166
ILE A 148
VAL A 151
LEU A 152
VAL A 157
 None
 1.14A 3w68C-3sd7A:
undetectable		 3w68C-3sd7A:
17.34
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.
3t0p DNA POLYMERASE III,
BETA SUBUNIT

([Eubacterium]
rectale) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 ILE A   4
ILE A  42
ILE A  35
LEU A  69
PHE A  94
 None
 1.12A 3w68C-3t0pA:
undetectable		 3w68C-3t0pA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t33 G PROTEIN COUPLED
RECEPTOR

(Arabidopsis
thaliana) 		PF05147
(LANC_like) 		5 LEU A 165
VAL A 196
VAL A 237
LEU A 238
VAL A 197
 None
 1.26A 3w68C-3t33A:
undetectable		 3w68C-3t33A:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t34 DYNAMIN-RELATED
PROTEIN 1A, LINKER,
DYNAMIN-RELATED
PROTEIN 1A

(Arabidopsis
thaliana) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M) 		5 ILE A   5
VAL A 238
ILE A 176
LEU A 178
VAL A 209
 None
 1.19A 3w68C-3t34A:
undetectable		 3w68C-3t34A:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tex PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF07691
(PA14)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		5 ILE A 656
PHE A 678
ILE A 689
ILE A 734
VAL A 619
 None
 1.17A 3w68C-3texA:
undetectable		 3w68C-3texA:
17.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tsy FUSION PROTEIN
4-COUMARATE--COA
LIGASE 1,
RESVERATROL SYNTHASE

(Arabidopsis
thaliana;
Vitis vinifera) 		PF00195
(Chal_sti_synt_N)
PF00501
(AMP-binding)
PF02797
(Chal_sti_synt_C)
PF13193
(AMP-binding_C) 		5 ILE A 299
VAL A  94
ILE A  67
LEU A  63
VAL A 228
 None
 1.01A 3w68C-3tsyA:
undetectable		 3w68C-3tsyA:
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.
3v11 TRANSLATION
INITIATION FACTOR 2
SUBUNIT ALPHA

(Sulfolobus
solfataricus) 		PF00575
(S1)
PF07541
(EIF_2_alpha) 		5 VAL B  29
ILE B  54
VAL B  57
LEU B  58
VAL B  19
 None
 1.18A 3w68C-3v11B:
undetectable		 3w68C-3v11B:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ve5 RECOMBINATION
PROTEIN RECR

(Caldanaerobacter
subterraneus) 		no annotation 5 VAL D 134
ILE D 109
ILE D 122
LEU D 126
VAL D 129
 None
 1.05A 3w68C-3ve5D:
undetectable		 3w68C-3ve5D:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ze7 PERIPLASMIC [NIFESE]
HYDROGENASE, LARGE
SUBUNIT,
SELENOCYSTEINE-CONTA
INING

(Desulfovibrio
vulgaris) 		PF00374
(NiFeSe_Hases) 		5 VAL B  37
ILE B  27
ILE B 483
LEU B 465
VAL B  42
 None
 0.89A 3w68C-3ze7B:
undetectable		 3w68C-3ze7B:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zpp CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF12708
(Pectate_lyase_3)
PF13229
(Beta_helix) 		5 VAL A 486
ILE A 496
ILE A 508
LEU A 510
VAL A 513
 None
 0.93A 3w68C-3zppA:
undetectable		 3w68C-3zppA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans) 		PF03599
(CdhD) 		5 ILE B 210
PHE B 245
ILE B 205
VAL B 176
LEU B 153
 None
 1.14A 3w68C-4c1nB:
undetectable		 3w68C-4c1nB:
23.18
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.
4d7e L-LYS MONOOXYGENASE

(Nocardia
farcinica) 		PF13434
(K_oxygenase) 		5 ILE A 233
VAL A 332
LEU A 182
VAL A 302
LEU A 316
 None
 1.26A 3w68C-4d7eA:
undetectable		 3w68C-4d7eA:
19.43
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.
4dzh AMIDOHYDROLASE

(Xanthomonas
campestris) 		PF01979
(Amidohydro_1) 		5 ILE A 193
VAL A 381
ILE A 124
LEU A 128
VAL A 412
 None
 1.07A 3w68C-4dzhA:
undetectable		 3w68C-4dzhA:
19.12
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.
4f5x RNA-DIRECTED RNA
POLYMERASE

(Rotavirus A) 		PF02123
(RdRP_4)
PF12289
(Rotavirus_VP1) 		5 ILE W 677
VAL W 651
ILE W 608
VAL W 611
LEU W 612
 None
 1.22A 3w68C-4f5xW:
undetectable		 3w68C-4f5xW:
14.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gdl AUTOPHAGY PROTEIN 5

(Homo sapiens) 		PF04106
(APG5) 		5 TRP B 253
LEU B 247
VAL B 222
ILE B 240
VAL B 238
 None
 1.21A 3w68C-4gdlB:
undetectable		 3w68C-4gdlB:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gul PIRIN

(Homo sapiens) 		PF02678
(Pirin)
PF05726
(Pirin_C) 		5 VAL A 228
ILE A  28
VAL A   7
LEU A 220
VAL A 226
 None
 1.20A 3w68C-4gulA:
undetectable		 3w68C-4gulA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h2k SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20) 		5 VAL A  70
VAL A   5
VAL A 244
LEU A  93
VAL A   6
 None
 1.26A 3w68C-4h2kA:
undetectable		 3w68C-4h2kA:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j38 OUTER SURFACE
PROTEIN E

(Borreliella
burgdorferi) 		PF02471
(OspE) 		5 VAL A  99
LEU A 170
PHE A 144
VAL A  65
LEU A  63
 None
 1.23A 3w68C-4j38A:
undetectable		 3w68C-4j38A:
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.
4mr0 PLASMIN AND
FIBRONECTIN-BINDING
PROTEIN A

(Streptococcus
pneumoniae) 		PF12708
(Pectate_lyase_3)
PF13229
(Beta_helix) 		5 VAL A 497
ILE A 507
ILE A 519
LEU A 521
VAL A 524
 None
 0.87A 3w68C-4mr0A:
undetectable		 3w68C-4mr0A:
16.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ofy PROTEIN SYG-2

(Caenorhabditis
elegans) 		PF08205
(C2-set_2)
PF13927
(Ig_3) 		5 VAL D 228
ILE D 150
VAL D 196
LEU D 148
VAL D 142
 None
 1.13A 3w68C-4ofyD:
undetectable		 3w68C-4ofyD:
20.67
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.
4r0c ABGT PUTATIVE
TRANSPORTER FAMILY

(Alcanivorax
borkumensis) 		PF03806
(ABG_transport) 		5 LEU A 411
ILE A 484
LEU A 480
PHE A 382
VAL A 427
 None
 1.18A 3w68C-4r0cA:
undetectable		 3w68C-4r0cA:
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.
4s2t PROTEIN APP-1

(Caenorhabditis
elegans) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2) 		5 ILE P 269
TRP P 268
VAL P 184
LEU P 187
VAL P 311
 None
None
None
SO4  P 703 (-3.8A)
SO4  P 703 (-4.6A)
 1.01A 3w68C-4s2tP:
undetectable		 3w68C-4s2tP:
19.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u3a ENDOGLUCANASE H

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase) 		5 ILE A 191
TRP A 129
VAL A 127
LEU A  91
PHE A 115
 None
 1.20A 3w68C-4u3aA:
2.7		 3w68C-4u3aA:
20.25
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.
4w64 TYPE VI SECRETION
SYSTEM EFFECTOR,
HCP1 FAMILY

(Acinetobacter
baumannii) 		PF05638
(T6SS_HCP) 		5 PHE A  62
ILE A 104
VAL A 135
LEU A 106
VAL A 109
 None
 1.16A 3w68C-4w64A:
undetectable		 3w68C-4w64A:
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.
4xri PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		5 VAL A 620
ILE A 596
ILE A 603
VAL A 606
LEU A 607
 None
 0.84A 3w68C-4xriA:
undetectable		 3w68C-4xriA:
16.24
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.
4zrs ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 LEU A  55
ILE A 145
VAL A  70
LEU A 147
VAL A 157
 None
 1.12A 3w68C-4zrsA:
0.0		 3w68C-4zrsA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zxo GLYCOSYL HYDROLASE
FAMILY 26

(Bacteroides
ovatus) 		PF02156
(Glyco_hydro_26) 		6 TRP A 195
VAL A 126
VAL A 181
ILE A 161
LEU A 217
VAL A 225
 None
 0.96A 3w68C-4zxoA:
1.6		 3w68C-4zxoA:
22.40
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.
5ey9 LONG-CHAIN-FATTY-ACI
D--AMP LIGASE FADD32

(Mycobacterium
marinum) 		PF00501
(AMP-binding) 		5 ILE A  92
VAL A 242
PHE A  95
ILE A  82
LEU A 203
 None
 1.13A 3w68C-5ey9A:
undetectable		 3w68C-5ey9A:
17.54
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.
5fud O-ACETYL-ADP-RIBOSE
DEACETYLASE

(Oceanobacillus
iheyensis) 		PF01661
(Macro) 		5 ILE A  75
VAL A 163
ILE A  43
VAL A  39
VAL A 164
 None
 1.25A 3w68C-5fudA:
undetectable		 3w68C-5fudA:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h9d FARNESYL
PYROPHOSPHATE
SYNTHETASE

(Staphylococcus
aureus) 		PF00348
(polyprenyl_synt) 		5 VAL A 191
ILE A  74
ILE A 133
VAL A 129
LEU A 132
 None
 0.93A 3w68C-5h9dA:
3.4		 3w68C-5h9dA:
23.23
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.
5hc8 PRENYLTRANSFERENCE
FOR PROTEIN

(Lavandula
lanata) 		PF01255
(Prenyltransf) 		5 ILE A 138
VAL A 151
PHE A 142
ILE A  75
ILE A 117
 None
 1.10A 3w68C-5hc8A:
undetectable		 3w68C-5hc8A:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hzw MALTOSE-BINDING
PERIPLASMIC
PROTEIN,ENDOGLIN

(Escherichia
coli;
Homo sapiens) 		PF13416
(SBP_bac_8) 		5 VAL A 650
LEU A 640
VAL A 604
ILE A 710
VAL A 435
 None
 1.26A 3w68C-5hzwA:
2.0		 3w68C-5hzwA:
17.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j62 PUTATIVE REDUCTASE

(Clostridioides
difficile) 		PF00881
(Nitroreductase) 		5 VAL A  56
LEU A 179
ILE A 118
ILE A  98
VAL A 187
 None
 0.87A 3w68C-5j62A:
undetectable		 3w68C-5j62A:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jxd TUMOR NECROSIS
FACTOR ALPHA-INDUCED
PROTEIN 8

(Mus musculus) 		PF05527
(DUF758) 		5 LEU A 128
ILE A 198
ILE A 189
LEU A 185
VAL A  57
 None
None
6OU  A 201 ( 4.9A)
None
None
 1.01A 3w68C-5jxdA:
undetectable		 3w68C-5jxdA:
23.72
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.
5lc8 ARACHIDONATE
15-LIPOXYGENASE

(Pseudomonas
aeruginosa) 		PF00305
(Lipoxygenase) 		5 ILE A 685
VAL A  89
ILE A 608
LEU A 425
VAL A  86
 None
None
ZPE  A 703 ( 4.9A)
None
None
 0.99A 3w68C-5lc8A:
undetectable		 3w68C-5lc8A:
19.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mue ALPHA-TOCOPHEROL
TRANSFER PROTEIN

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		11 ILE A 119
TRP A 122
VAL A 132
LEU A 137
PHE A 158
ILE A 171
ILE A 179
VAL A 182
LEU A 183
PHE A 187
VAL A 191
 None
None
VIV  A 302 (-4.4A)
VIV  A 302 ( 4.8A)
VIV  A 302 (-3.9A)
VIV  A 302 ( 4.8A)
VIV  A 302 (-4.0A)
VIV  A 302 (-4.4A)
None
VIV  A 302 (-4.0A)
VIV  A 302 ( 4.9A)
 0.47A 3w68C-5mueA:
33.6		 3w68C-5mueA:
92.98
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.
5vj4 UNCHARACTERIZED
PROTEIN

(Borrelia
turicatae) 		no annotation 5 ILE A 219
VAL A 227
ILE A 194
ILE A 197
VAL A 263
 None
 0.95A 3w68C-5vj4A:
undetectable		 3w68C-5vj4A:
22.40
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.
5wml -

(-) 		no annotation 5 ILE A 274
ILE A 237
VAL A 186
LEU A 235
VAL A 179
 PMP  A 501 ( 4.7A)
None
None
None
None
 1.17A 3w68C-5wmlA:
undetectable		 3w68C-5wmlA:
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.
5wtk CRISPR-ASSOCIATED
ENDORIBONUCLEASE
C2C2

(Leptotrichia
shahii) 		no annotation 5 ILE A  80
VAL A 298
ILE A 203
ILE A 207
VAL A 215
 None
 1.10A 3w68C-5wtkA:
undetectable		 3w68C-5wtkA:
10.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5z38 TRUNCATED-CSRA
WILD TYPE CSRA

(Escherichia
coli;
Escherichia
coli) 		no annotation
no annotation 		5 LEU E  12
VAL E  30
ILE F  14
VAL F  20
LEU F  12
 None
 1.04A 3w68C-5z38E:
undetectable		 3w68C-5z38E:
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.
5z38 TRUNCATED-CSRA
WILD TYPE CSRA

(Escherichia
coli;
Escherichia
coli) 		no annotation
no annotation 		5 LEU F  12
VAL F  30
ILE E  14
VAL E  20
LEU E  12
 None
 0.95A 3w68C-5z38F:
undetectable		 3w68C-5z38F:
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.
6b67 PROTEIN PHOSPHATASE
1A

(Homo sapiens) 		no annotation 5 ILE A 224
ILE A 134
ILE A 289
LEU A 288
VAL A 254
 None
 1.26A 3w68C-6b67A:
undetectable		 3w68C-6b67A:
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.
6d6q EXOSOME COMPLEX
COMPONENT RRP4

(Homo sapiens) 		no annotation 5 ILE H 205
ILE H 241
VAL H 245
LEU H 244
VAL H 281
 None
 1.25A 3w68C-6d6qH:
2.7		 3w68C-6d6qH:
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.
6d6v TELOMERASE REVERSE
TRANSCRIPTASE

(Tetrahymena
thermophila) 		no annotation 5 VAL A 409
PHE A 401
ILE A 314
ILE A 467
VAL A 471
 None
 1.02A 3w68C-6d6vA:
undetectable		 3w68C-6d6vA:
undetectable