SIMILAR PATTERNS OF AMINO ACIDS FOR 2XAT_A_CLMA301

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.
1dj0 PSEUDOURIDINE
SYNTHASE I

(Escherichia
coli) 		PF01416
(PseudoU_synth_1) 		3 GLY A  20
TYR A  23
SER A  21
 None
 0.75A 2xatA-1dj0A:
0.0		 2xatA-1dj0A:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h5y HISF

(Pyrobaculum
aerophilum) 		PF00977
(His_biosynth) 		3 GLY A 205
TYR A 185
SER A 204
 PO4  A 302 (-3.6A)
None
PO4  A 302 ( 4.5A)
 0.71A 2xatA-1h5yA:
0.0		 2xatA-1h5yA:
21.92
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.
1itx GLYCOSYL HYDROLASE

(Bacillus
circulans) 		PF00704
(Glyco_hydro_18) 		3 GLY A 437
TYR A 373
SER A 436
 None
 0.68A 2xatA-1itxA:
0.0		 2xatA-1itxA:
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.
1ka9 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE

(Thermus
thermophilus) 		PF00977
(His_biosynth) 		3 GLY F 203
TYR F 183
SER F 202
 None
 0.71A 2xatA-1ka9F:
0.0		 2xatA-1ka9F:
21.84
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.
1p1p AA-CONOTOXIN PIVA

(Conus
purpurascens) 		PF07829
(Toxin_14) 		3 GLY A   4
TYR A   6
SER A   5
 None
 0.66A 2xatA-1p1pA:
undetectable		 2xatA-1p1pA:
7.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vpv UPF0230 PROTEIN
TM1468

(Thermotoga
maritima) 		PF02645
(DegV) 		3 GLY A 227
TYR A 254
SER A 228
 None
 0.73A 2xatA-1vpvA:
undetectable		 2xatA-1vpvA:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xat XENOBIOTIC
ACETYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00132
(Hexapep) 		3 GLY A  11
TYR A  30
SER A  32
 None
 0.23A 2xatA-1xatA:
28.7		 2xatA-1xatA:
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.
1y1p ALDEHYDE REDUCTASE
II

(Sporidiobolus
salmonicolor) 		PF01370
(Epimerase) 		3 GLY A  12
TYR A  37
SER A  13
 None
 0.74A 2xatA-1y1pA:
undetectable		 2xatA-1y1pA:
18.62
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.
2drq XYLANASE Y

(Bacillus
halodurans) 		PF01270
(Glyco_hydro_8) 		3 GLY A 263
TYR A 265
SER A 264
 None
 0.68A 2xatA-2drqA:
undetectable		 2xatA-2drqA:
18.80
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.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT

(Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox)
PF04945
(YHS) 		3 GLY A  88
TYR A 280
SER A  91
 None
 0.73A 2xatA-2incA:
undetectable		 2xatA-2incA:
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.
2jdf GAMMA CRYSTALLIN B

(Homo sapiens) 		PF00030
(Crystall) 		3 GLY A 129
TYR A  88
SER A 130
 None
 0.75A 2xatA-2jdfA:
undetectable		 2xatA-2jdfA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2l8y PROTEIN RCSF

(Escherichia
coli) 		PF16358
(RcsF) 		3 GLY A 114
TYR A 119
SER A 113
 None
 0.57A 2xatA-2l8yA:
undetectable		 2xatA-2l8yA:
17.96
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.
2lle CHEMOTAXIS PROTEIN
CHEY, IMIDAZOLE
GLYCEROL PHOSPHATE
SYNTHASE SUBUNIT
HISF CHIMERA

(Thermotoga
maritima) 		PF00072
(Response_reg)
PF00977
(His_biosynth) 		3 GLY A 181
TYR A 161
SER A 180
 None
 0.63A 2xatA-2lleA:
undetectable		 2xatA-2lleA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2m9p SERINE PROTEASE
SUBUNIT NS2B, SERINE
PROTEASE NS3

(Dengue virus) 		PF00949
(Peptidase_S7)
PF01002
(Flavi_NS2B) 		3 GLY A 212
TYR A 211
SER A 196
 None
 0.58A 2xatA-2m9pA:
undetectable		 2xatA-2m9pA:
20.33
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.
2o5v DNA REPLICATION AND
REPAIR PROTEIN RECF

(Deinococcus
radiodurans) 		PF02463
(SMC_N) 		3 GLY A 147
TYR A 146
SER A 140
 None
 0.76A 2xatA-2o5vA:
undetectable		 2xatA-2o5vA:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qty POLY(ADP-RIBOSE)
GLYCOHYDROLASE ARH3

(Mus musculus) 		PF03747
(ADP_ribosyl_GH) 		3 GLY A 171
TYR A 172
SER A 168
 None
 0.72A 2xatA-2qtyA:
undetectable		 2xatA-2qtyA:
20.11
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.
2r1v DJ-1

(Homo sapiens) 		PF01965
(DJ-1_PfpI) 		3 GLY A 120
TYR A 139
SER A 121
 None
 0.67A 2xatA-2r1vA:
undetectable		 2xatA-2r1vA:
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.
2ri8 MANNOSYL-OLIGOSACCHA
RIDE
ALPHA-1,2-MANNOSIDAS
E

(Penicillium
citrinum) 		PF01532
(Glyco_hydro_47) 		3 GLY A1336
TYR A1416
SER A1413
 None
 0.76A 2xatA-2ri8A:
undetectable		 2xatA-2ri8A:
16.84
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.
2rko VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 4

(Saccharomyces
cerevisiae) 		PF00004
(AAA)
PF09336
(Vps4_C) 		3 GLY A 178
TYR A 181
SER A 180
 None
 0.78A 2xatA-2rkoA:
2.1		 2xatA-2rkoA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w6r IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
SUBUNIT HISF

(Thermotoga
maritima) 		PF00977
(His_biosynth) 		3 GLY A  81
TYR A  61
SER A  80
 None
 0.74A 2xatA-2w6rA:
undetectable		 2xatA-2w6rA:
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.
2w6r IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
SUBUNIT HISF

(Thermotoga
maritima) 		PF00977
(His_biosynth) 		3 GLY A 207
TYR A 187
SER A 206
 None
 0.63A 2xatA-2w6rA:
undetectable		 2xatA-2w6rA:
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.
2x7v PROBABLE
ENDONUCLEASE 4

(Thermotoga
maritima) 		PF01261
(AP_endonuc_2) 		3 GLY A 182
TYR A 187
SER A 185
 None
 0.60A 2xatA-2x7vA:
undetectable		 2xatA-2x7vA:
18.92
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.
3azq AMINOPEPTIDASE

(Streptomyces
morookaense) 		PF00326
(Peptidase_S9) 		3 GLY A 463
TYR A 471
SER A 464
 None
 0.63A 2xatA-3azqA:
undetectable		 2xatA-3azqA:
15.41
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.
3bb7 INTERPAIN A

(Prevotella
intermedia) 		PF01640
(Peptidase_C10)
PF13734
(Inhibitor_I69) 		3 GLY A 174
TYR A 256
SER A 175
 None
 0.64A 2xatA-3bb7A:
undetectable		 2xatA-3bb7A:
20.78
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.
3bba INTERPAIN A

(Prevotella
intermedia) 		PF01640
(Peptidase_C10) 		3 GLY A 174
TYR A 256
SER A 175
 None
 0.63A 2xatA-3bbaA:
undetectable		 2xatA-3bbaA:
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.
3bv6 METAL-DEPENDENT
HYDROLASE

(Vibrio cholerae) 		PF13483
(Lactamase_B_3) 		3 GLY A 220
TYR A 324
SER A 221
 None
 0.76A 2xatA-3bv6A:
undetectable		 2xatA-3bv6A:
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.
3c49 POLY(ADP-RIBOSE)
POLYMERASE 3

(Homo sapiens) 		PF00644
(PARP)
PF02877
(PARP_reg) 		3 GLY A 385
TYR A 425
SER A 422
 KU8  A 601 (-3.5A)
KU8  A 601 (-3.5A)
KU8  A 601 (-2.9A)
 0.71A 2xatA-3c49A:
undetectable		 2xatA-3c49A:
19.89
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.
3c9f 5'-NUCLEOTIDASE

(Candida
albicans) 		PF00149
(Metallophos) 		3 GLY A 275
TYR A 298
SER A 267
 None
 0.72A 2xatA-3c9fA:
undetectable		 2xatA-3c9fA:
15.61
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.
3fid PUTATIVE OUTER
MEMBRANE PROTEIN
(LPXR)

(Salmonella
enterica) 		PF09982
(DUF2219) 		3 GLY A 180
TYR A 178
SER A 169
 None
 0.76A 2xatA-3fidA:
undetectable		 2xatA-3fidA:
20.00
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.
3gzf REPLICASE
POLYPROTEIN 1AB

(Alphacoronavirus
1) 		PF16348
(Corona_NSP4_C) 		3 GLY A  53
TYR A  51
SER A  54
 None
 0.61A 2xatA-3gzfA:
undetectable		 2xatA-3gzfA:
15.17
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.
3hdi PROCESSING PROTEASE

(Bacillus
halodurans) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		3 GLY A 153
TYR A 147
SER A 143
 None
 0.75A 2xatA-3hdiA:
undetectable		 2xatA-3hdiA:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k5h PHOSPHORIBOSYL-AMINO
IMIDAZOLE
CARBOXYLASE

(Aspergillus
clavatus) 		PF01262
(AlaDh_PNT_C)
PF02222
(ATP-grasp) 		3 GLY A 276
TYR A 278
SER A 275
 None
 0.78A 2xatA-3k5hA:
undetectable		 2xatA-3k5hA:
18.86
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.
3l5a NADH/FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE

(Staphylococcus
aureus) 		PF00724
(Oxidored_FMN) 		3 GLY A 240
TYR A 241
SER A 182
 None
 0.65A 2xatA-3l5aA:
undetectable		 2xatA-3l5aA:
20.82
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.
3la6 TYROSINE-PROTEIN
KINASE WZC

(Escherichia
coli) 		PF13614
(AAA_31) 		3 GLY A 692
TYR A 467
SER A 465
 None
 0.74A 2xatA-3la6A:
undetectable		 2xatA-3la6A:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lly AGGLUTININ ALPHA
CHAIN

(Maclura
pomifera) 		PF01419
(Jacalin) 		3 GLY A  97
TYR A  19
SER A  21
 None
 0.66A 2xatA-3llyA:
undetectable		 2xatA-3llyA:
20.00
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.
3mko GLYCOPROTEIN C

(Lymphocytic
choriomeningitis
mammarenavirus) 		PF00798
(Arena_glycoprot) 		3 GLY A 397
TYR A 399
SER A 398
 None
None
MPD  A  93 (-3.6A)
 0.73A 2xatA-3mkoA:
undetectable		 2xatA-3mkoA:
17.16
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.
3mxg SHIGA-LIKE TOXIN 2
SUBUNIT B

(Escherichia
coli) 		PF02258
(SLT_beta) 		3 GLY A  59
TYR A  28
SER A  60
 None
 0.59A 2xatA-3mxgA:
undetectable		 2xatA-3mxgA:
12.56
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.
3na8 PUTATIVE
DIHYDRODIPICOLINATE
SYNTHETASE

(Pseudomonas
aeruginosa) 		PF00701
(DHDPS) 		3 GLY A  66
TYR A  31
SER A  67
 None
 0.76A 2xatA-3na8A:
undetectable		 2xatA-3na8A:
22.36
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.
3ndn O-SUCCINYLHOMOSERINE
SULFHYDRYLASE

(Mycobacterium
tuberculosis) 		PF01053
(Cys_Met_Meta_PP) 		3 GLY A  45
TYR A  67
SER A  44
 None
 0.75A 2xatA-3ndnA:
undetectable		 2xatA-3ndnA:
20.05
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.
3ngm EXTRACELLULAR LIPASE

(Fusarium
graminearum) 		PF01764
(Lipase_3) 		3 GLY A  64
TYR A  65
SER A  26
 None
 0.77A 2xatA-3ngmA:
undetectable		 2xatA-3ngmA:
24.64
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.
3o26 SALUTARIDINE
REDUCTASE

(Papaver
somniferum) 		PF00106
(adh_short)
PF13561
(adh_short_C2) 		3 GLY A 183
TYR A 187
SER A 184
 None
 0.76A 2xatA-3o26A:
0.3		 2xatA-3o26A:
18.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o3m BETA SUBUNIT
2-HYDROXYACYL-COA
DEHYDRATASE

(Clostridioides
difficile) 		PF06050
(HGD-D) 		3 GLY B  55
TYR B  81
SER B  77
 None
 0.72A 2xatA-3o3mB:
0.4		 2xatA-3o3mB:
19.65
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.
3p11 RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-3

(Homo sapiens) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		3 GLY A 376
TYR A 377
SER A 403
 None
 0.58A 2xatA-3p11A:
undetectable		 2xatA-3p11A:
17.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qtd PMBA PROTEIN

(Pseudomonas
aeruginosa) 		PF01523
(PmbA_TldD) 		3 GLY A 265
TYR A 269
SER A 332
 None
 0.70A 2xatA-3qtdA:
undetectable		 2xatA-3qtdA:
17.84
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.
3r2p APOLIPOPROTEIN A-I

(Homo sapiens) 		PF01442
(Apolipoprotein) 		3 GLY A  26
TYR A  29
SER A  25
 None
 0.77A 2xatA-3r2pA:
undetectable		 2xatA-3r2pA:
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.
3tdm COMPUTATIONALLY
DESIGNED TWO-FOLD
SYMMETRIC TIM-BARREL
PROTEIN, FLR (HALF
MOLECULE)

(synthetic
construct) 		PF00977
(His_biosynth) 		3 GLY A  81
TYR A  61
SER A  80
 PO4  A 122 ( 3.9A)
None
PO4  A 122 ( 4.3A)
 0.63A 2xatA-3tdmA:
undetectable		 2xatA-3tdmA:
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.
3tdn FLR SYMMETRIC
ALPHA-BETA TIM
BARREL

(synthetic
construct) 		PF00977
(His_biosynth) 		3 GLY A  81
TYR A  61
SER A  80
 None
 0.71A 2xatA-3tdnA:
undetectable		 2xatA-3tdnA:
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.
3ve9 OROTIDINE-5'-PHOSPHA
TE DECARBOXYLASE

(Metallosphaera
sedula) 		PF00215
(OMPdecase) 		3 GLY A 180
TYR A 184
SER A   7
 None
None
GOL  A 301 ( 4.6A)
 0.62A 2xatA-3ve9A:
0.6		 2xatA-3ve9A:
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.
3vsc PROTEIN CYSO

(Aeropyrum
pernix) 		PF00291
(PALP) 		3 GLY A 145
TYR A 169
SER A 146
 None
 0.68A 2xatA-3vscA:
undetectable		 2xatA-3vscA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wdb PROBABLE
ATP-DEPENDENT CLP
PROTEASE ATP-BINDING
SUBUNIT

(Mycobacterium
tuberculosis) 		PF02861
(Clp_N) 		3 GLY A 144
TYR A 145
SER A 143
 None
 0.75A 2xatA-3wdbA:
undetectable		 2xatA-3wdbA:
19.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4at0 3-KETOSTEROID-DELTA4
-5ALPHA-DEHYDROGENAS
E

(Rhodococcus
jostii) 		PF00890
(FAD_binding_2) 		3 GLY A 148
TYR A 319
SER A 147
 None
 0.68A 2xatA-4at0A:
undetectable		 2xatA-4at0A:
16.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c53 PRE-GLYCOPROTEIN
POLYPROTEIN GP
COMPLEX

(Guanarito
mammarenavirus) 		PF00798
(Arena_glycoprot) 		3 GLY A 377
TYR A 379
SER A 378
 None
 0.75A 2xatA-4c53A:
undetectable		 2xatA-4c53A:
15.28
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.
4cad RAS AND A-FACTOR
CONVERTING ENZYME 1,
RCE1

(Methanococcus
maripaludis) 		PF02517
(Abi) 		3 GLY C  38
TYR C  40
SER C  37
 None
 0.75A 2xatA-4cadC:
undetectable		 2xatA-4cadC:
21.30
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.
4e4j ARGININE DEIMINASE

(Mycoplasma
penetrans) 		PF02274
(Amidinotransf) 		3 GLY A 177
TYR A  78
SER A 176
 None
 0.66A 2xatA-4e4jA:
undetectable		 2xatA-4e4jA:
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.
4evz HISF-LUCA

(synthetic
construct) 		PF00977
(His_biosynth) 		3 GLY A 202
TYR A 182
SER A 201
 PI  A 301 (-3.5A)
None
PI  A 301 ( 4.7A)
 0.69A 2xatA-4evzA:
undetectable		 2xatA-4evzA:
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.
4fxb PUTATIVE CYTOCHROME
P450

(Streptomyces
coelicolor) 		PF00067
(p450) 		3 GLY A 356
TYR A 355
SER A  69
 None
 0.66A 2xatA-4fxbA:
undetectable		 2xatA-4fxbA:
18.07
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.
4jva CAMP-DEPENDENT
PROTEIN KINASE TYPE
II-BETA REGULATORY
SUBUNIT

(Rattus
norvegicus) 		PF00027
(cNMP_binding) 		3 GLY A 217
TYR A 213
SER A 218
 None
 0.71A 2xatA-4jvaA:
undetectable		 2xatA-4jvaA:
21.84
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.
4kp4 OSMOLARITY SENSOR
PROTEIN ENVZ,
HISTIDINE KINASE

(Escherichia
coli;
Thermotoga
maritima) 		PF00512
(HisKA)
PF02518
(HATPase_c) 		3 GLY A1326
TYR A1324
SER A1327
 None
 0.69A 2xatA-4kp4A:
undetectable		 2xatA-4kp4A:
24.05
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.
4l4x AMPHI

(Streptomyces
nodosus) 		PF08659
(KR) 		3 GLY A 473
TYR A 507
SER A 472
 None
 0.68A 2xatA-4l4xA:
undetectable		 2xatA-4l4xA:
16.78
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.
4leo RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-3

(Homo sapiens) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		3 GLY C 376
TYR C 377
SER C 403
 None
 0.69A 2xatA-4leoC:
undetectable		 2xatA-4leoC:
16.58
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.
4ljp E3 UBIQUITIN-PROTEIN
LIGASE RNF31

(Homo sapiens) 		no annotation 3 GLY A 900
TYR A 902
SER A 899
 ZN  A1102 ( 4.3A)
None
None
 0.78A 2xatA-4ljpA:
undetectable		 2xatA-4ljpA:
22.18
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.
4lur INTERPHOTORECEPTOR
RETINOID-BINDING
PROTEIN(IRBP)

(Danio rerio) 		PF03572
(Peptidase_S41)
PF11918
(Peptidase_S41_N) 		3 GLY A 116
TYR A 158
SER A 154
 None
 0.76A 2xatA-4lurA:
undetectable		 2xatA-4lurA:
23.03
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.
4m7e PROTEIN
BRASSINOSTEROID
INSENSITIVE 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		3 GLY A 668
TYR A 669
SER A 691
 None
 0.66A 2xatA-4m7eA:
undetectable		 2xatA-4m7eA:
12.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4maa PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN

(Pseudomonas
protegens) 		PF13458
(Peripla_BP_6) 		3 GLY A 150
TYR A 149
SER A 388
 None
 0.74A 2xatA-4maaA:
undetectable		 2xatA-4maaA:
19.72
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.
4oa7 TANKYRASE-1

(Homo sapiens) 		PF00644
(PARP) 		3 GLY A1185
TYR A1224
SER A1221
 None
2XS  A1402 ( 3.9A)
None
 0.65A 2xatA-4oa7A:
undetectable		 2xatA-4oa7A:
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.
4ojz PUTATIVE ALGINATE
LYASE

(Saccharophagus
degradans) 		PF05426
(Alginate_lyase)
PF07940
(Hepar_II_III) 		3 GLY A 355
TYR A  53
SER A 350
 None
 0.74A 2xatA-4ojzA:
undetectable		 2xatA-4ojzA:
16.10
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.
4oqa POLY [ADP-RIBOSE]
POLYMERASE 1

(Homo sapiens) 		PF00644
(PARP)
PF02877
(PARP_reg)
PF05406
(WGR) 		3 GLY C 863
TYR C 907
SER C 904
 2US  C1101 (-3.3A)
2US  C1101 (-3.5A)
2US  C1101 (-3.4A)
 0.66A 2xatA-4oqaC:
undetectable		 2xatA-4oqaC:
16.33
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.
4p2c SHIGA TOXIN 2E,
SUBUNIT B

(Escherichia
coli) 		PF02258
(SLT_beta) 		3 GLY B  59
TYR B  28
SER B  60
 None
 0.67A 2xatA-4p2cB:
undetectable		 2xatA-4p2cB:
13.46
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.
4pr3 5'-METHYLTHIOADENOSI
NE NUCLEOSIDASE /
S-ADENOSYLHOMOCYSTEI
NE NUCLEOSIDASE

(Brucella
melitensis) 		PF01048
(PNP_UDP_1) 		3 GLY A 131
TYR A 134
SER A 130
 None
 0.73A 2xatA-4pr3A:
undetectable		 2xatA-4pr3A:
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.
4q9n ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Chlamydia
trachomatis) 		PF13561
(adh_short_C2) 		3 GLY A 103
TYR A 104
SER A 102
 None
 0.68A 2xatA-4q9nA:
undetectable		 2xatA-4q9nA:
20.00
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.
4tn0 UPF0141 PROTEIN YJDB

(Campylobacter
jejuni) 		PF00884
(Sulfatase) 		3 GLY A 226
TYR A 424
SER A 426
 None
 0.68A 2xatA-4tn0A:
undetectable		 2xatA-4tn0A:
18.71
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.
4w8y CRISPR SYSTEM CMR
SUBUNIT CMR2

(Pyrococcus
furiosus) 		PF12469
(DUF3692) 		3 GLY A 610
TYR A 636
SER A 609
 None
 0.69A 2xatA-4w8yA:
0.6		 2xatA-4w8yA:
12.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w97 HTH-TYPE
TRANSCRIPTIONAL
REPRESSOR KSTR2

(Mycobacterium
tuberculosis) 		PF00440
(TetR_N) 		3 GLY A  45
TYR A  48
SER A  44
 None
 0.77A 2xatA-4w97A:
undetectable		 2xatA-4w97A:
19.47
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.
4ync NADPH DEHYDROGENASE
1

(Saccharomyces
pastorianus) 		PF00724
(Oxidored_FMN) 		3 GLY A 119
TYR A 134
SER A 136
 None
 0.78A 2xatA-4yncA:
undetectable		 2xatA-4yncA:
20.50
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.
4zb6 PCURE2P4

(Phanerochaete
chrysosporium) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 GLY A 114
TYR A 118
SER A 113
 None
 0.78A 2xatA-4zb6A:
undetectable		 2xatA-4zb6A:
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.
4zb8 PCURE2P6

(Phanerochaete
chrysosporium) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 GLY A 113
TYR A 117
SER A 112
 None
 0.75A 2xatA-4zb8A:
undetectable		 2xatA-4zb8A:
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.
4zzy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo sapiens) 		PF00644
(PARP)
PF02877
(PARP_reg) 		3 GLY A 429
TYR A 473
SER A 470
 D7N  A1584 (-3.8A)
D7N  A1584 (-3.8A)
D7N  A1584 (-2.7A)
 0.75A 2xatA-4zzyA:
2.1		 2xatA-4zzyA:
19.67
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.
5aey PLASMID SEGREGATION
PROTEIN PARM

(Escherichia
coli) 		PF06406
(StbA) 		3 GLY A 272
TYR A 273
SER A 271
 None
 0.72A 2xatA-5aeyA:
undetectable		 2xatA-5aeyA:
19.68
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.
5aor DOSAGE COMPENSATION
REGULATOR

(Drosophila
melanogaster) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		3 GLY A 431
TYR A 360
SER A 357
 None
 0.73A 2xatA-5aorA:
undetectable		 2xatA-5aorA:
9.42
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.
5azb PROLIPOPROTEIN
DIACYLGLYCERYL
TRANSFERASE

(Escherichia
coli) 		PF01790
(LGT) 		3 GLY A 236
TYR A 235
SER A 267
 None
PLM  A 301 (-4.7A)
None
 0.73A 2xatA-5azbA:
0.8		 2xatA-5azbA:
19.28
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.
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo sapiens) 		PF00644
(PARP) 		3 GLY A 416
TYR A 460
SER A 457
 UHB  A1001 (-3.9A)
UHB  A1001 (-3.4A)
UHB  A1001 (-2.5A)
 0.75A 2xatA-5dsyA:
undetectable		 2xatA-5dsyA:
20.96
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.
5e9j MRNA CAP GUANINE-N7
METHYLTRANSFERASE,MR
NA CAP GUANINE-N7
METHYLTRANSFERASE

(Homo sapiens) 		PF03291
(Pox_MCEL) 		3 GLY A 418
TYR A 171
SER A 419
 None
 0.75A 2xatA-5e9jA:
undetectable		 2xatA-5e9jA:
19.58
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.
5g0q BETA-GLUCURONIDASE

(Acidobacterium
capsulatum) 		PF03662
(Glyco_hydro_79n) 		3 GLY A 416
TYR A 452
SER A 415
 None
 0.77A 2xatA-5g0qA:
undetectable		 2xatA-5g0qA:
18.45
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.
5gp4 GLUTAMATE
DECARBOXYLASE

(Lactobacillus
brevis) 		no annotation 3 GLY C 250
TYR C 280
SER C 249
 None
None
PLP  C 501 ( 4.6A)
 0.77A 2xatA-5gp4C:
0.6		 2xatA-5gp4C:
16.88
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.
5gsz KINESIN-LIKE PROTEIN
KIF19

(Mus musculus) 		PF00225
(Kinesin) 		3 GLY A  91
TYR A  96
SER A  94
 None
 0.62A 2xatA-5gszA:
undetectable		 2xatA-5gszA:
18.08
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.
5mqs BETA-L-ARABINOBIOSID
ASE

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2) 		3 GLY A 996
TYR A1017
SER A1014
 None
 0.64A 2xatA-5mqsA:
undetectable		 2xatA-5mqsA:
10.74
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.
5mtz RIBONUCLEASE Z

(Saccharomyces
cerevisiae) 		PF13691
(Lactamase_B_4) 		3 GLY A 698
TYR A 696
SER A 539
 None
 0.70A 2xatA-5mtzA:
undetectable		 2xatA-5mtzA:
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.
5n4l CERULOPLASMIN

(Rattus
norvegicus) 		no annotation 3 GLY A 600
TYR A 365
SER A 597
 None
 0.72A 2xatA-5n4lA:
undetectable		 2xatA-5n4lA:
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.
5or4 CATECHOL OXIDASE

(Aspergillus
oryzae) 		no annotation 3 GLY A 195
TYR A 171
SER A 194
 None
 0.66A 2xatA-5or4A:
undetectable		 2xatA-5or4A:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ux9 CHLORAMPHENICOL
ACETYLTRANSFERASE

(Aliivibrio
fischeri) 		PF00132
(Hexapep) 		3 GLY A  10
TYR A  29
SER A  31
 None
 0.64A 2xatA-5ux9A:
23.4		 2xatA-5ux9A:
49.78
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.
5van BETA-KLOTHO

(Homo sapiens) 		no annotation 3 GLY A 927
TYR A 929
SER A 526
 None
 0.61A 2xatA-5vanA:
undetectable		 2xatA-5vanA:
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.
5vh6 ELONGATION FACTOR G

(Bacillus
subtilis) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2) 		3 GLY A 111
TYR A 146
SER A 110
 None
 0.77A 2xatA-5vh6A:
undetectable		 2xatA-5vh6A:
17.27
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.
5w7a ACYLOXYACYL
HYDROLASE LARGE
SUBUNIT

(Oryctolagus
cuniculus) 		no annotation 3 GLY B 197
TYR B 198
SER B 190
 None
 0.70A 2xatA-5w7aB:
undetectable		 2xatA-5w7aB:
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.
5w7c ACYLOXYACYL
HYDROLASE

(Homo sapiens) 		no annotation 3 GLY C 198
TYR C 199
SER C 191
 None
 0.76A 2xatA-5w7cC:
undetectable		 2xatA-5w7cC:
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.
5w7d ACYLOXYACYL
HYDROLASE

(Mus musculus) 		no annotation 3 GLY A 197
TYR A 198
SER A 190
 None
 0.72A 2xatA-5w7dA:
undetectable		 2xatA-5w7dA:
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.
5wdu BNAB NIH45-46 SCFV
LIGHT CHAIN

(Homo sapiens) 		no annotation 3 GLY E  29
TYR E  89
SER E  30
 NAG  G 633 ( 4.5A)
None
None
 0.78A 2xatA-5wduE:
undetectable		 2xatA-5wduE:
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.
5xyh CBSA

(Xanthomonas
oryzae) 		no annotation 3 GLY A 345
TYR A 351
SER A 344
 None
 0.74A 2xatA-5xyhA:
undetectable		 2xatA-5xyhA:
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.
5yje PROTEIN HIRA

(Homo sapiens) 		no annotation 3 GLY A 784
TYR A 786
SER A 785
 None
 0.69A 2xatA-5yjeA:
undetectable		 2xatA-5yjeA:
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.
6bnf PHOSPHOETHANOLAMINE
TRANSFERASE

(Moraxella sp.
HMSC061H09) 		no annotation 3 GLY A 272
TYR A 495
SER A 497
 None
 0.75A 2xatA-6bnfA:
undetectable		 2xatA-6bnfA:
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.
6erc PEROXINECTIN A

(Dictyostelium
discoideum) 		no annotation 3 GLY A  29
TYR A 169
SER A  41
 None
 0.77A 2xatA-6ercA:
undetectable		 2xatA-6ercA:
undetectable