SIMILAR PATTERNS OF AMINO ACIDS FOR 4WNU_C_QDNC602

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.
1a5c FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE

(Plasmodium
falciparum) 		PF00274
(Glycolytic) 		5 LEU A  68
GLY A 308
GLU A  40
GLN A 312
ALA A  81
 None
 1.06A 4wnuC-1a5cA:
0.0		 4wnuC-1a5cA:
20.12
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.
1b0k PROTEIN (ACONITASE)

(Sus scrofa) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		5 LEU A 228
GLY A 204
ALA A 265
SER A 268
PHE A 270
 None
 1.30A 4wnuC-1b0kA:
0.0		 4wnuC-1b0kA:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bgx TP7 MAB

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 LEU H  20
GLY H  10
LEU H  11
ALA H  88
ASP H  86
 None
 1.19A 4wnuC-1bgxH:
undetectable		 4wnuC-1bgxH:
18.30
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.
1c1k BPT4 GENE 59
HELICASE ASSEMBLY
PROTEIN

(Escherichia
virus T4) 		PF08993
(T4_Gp59_N)
PF08994
(T4_Gp59_C) 		5 LEU A 151
PHE A 113
LEU A 168
ASP A 116
PHE A 167
 None
 1.31A 4wnuC-1c1kA:
0.0		 4wnuC-1c1kA:
16.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dih DIHYDRODIPICOLINATE
REDUCTASE

(Escherichia
coli) 		PF01113
(DapB_N)
PF05173
(DapB_C) 		5 LEU A 268
LEU A 254
PHE A 129
ALA A 126
ASP A 263
 None
 1.37A 4wnuC-1dihA:
0.0		 4wnuC-1dihA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pxt PEROXISOMAL
3-KETOACYL-COA
THIOLASE

(Saccharomyces
cerevisiae) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLY A 374
LEU A 373
GLN A 275
ALA A 208
SER A 211
 None
 1.15A 4wnuC-1pxtA:
0.0		 4wnuC-1pxtA:
21.79
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.
1via SHIKIMATE KINASE

(Campylobacter
jejuni) 		PF01202
(SKI) 		5 GLY A  83
ALA A  79
ASP A  34
SER A  35
PHE A  59
 SO4  A 176 (-4.2A)
None
None
None
None
 1.21A 4wnuC-1viaA:
0.0		 4wnuC-1viaA:
15.03
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.
1wix HOOK HOMOLOG 1

(Mus musculus) 		PF05622
(HOOK) 		5 LEU A  56
PHE A  21
GLY A  36
LEU A  33
ALA A  24
 None
 1.38A 4wnuC-1wixA:
undetectable		 4wnuC-1wixA:
17.07
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.
1x1o NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE

(Thermus
thermophilus) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		5 LEU A  22
GLY A  99
LEU A 101
PHE A  65
ALA A 107
 None
 1.09A 4wnuC-1x1oA:
undetectable		 4wnuC-1x1oA:
22.08
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.
1x3o ACYL CARRIER PROTEIN

(Thermus
thermophilus) 		PF00550
(PP-binding) 		5 GLY A  48
LEU A  49
GLU A  52
ALA A  15
PHE A  53
 None
 1.08A 4wnuC-1x3oA:
undetectable		 4wnuC-1x3oA:
12.06
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.
1xrs D-LYSINE
5,6-AMINOMUTASE
ALPHA SUBUNIT

(Acetoanaerobium
sticklandii) 		PF09043
(Lys-AminoMut_A) 		5 LEU A 301
GLY A 337
LEU A 336
SER A 316
PHE A 364
 None
 1.16A 4wnuC-1xrsA:
0.0		 4wnuC-1xrsA:
22.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yks GENOME POLYPROTEIN
[CONTAINS:
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT]

(Yellow fever
virus) 		PF00271
(Helicase_C)
PF07652
(Flavi_DEAD) 		5 GLY A 303
LEU A 512
GLU A 516
ALA A 297
ASP A 295
 None
 1.19A 4wnuC-1yksA:
undetectable		 4wnuC-1yksA:
22.59
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.
2bf6 EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF13088
(BNR_2) 		5 GLY A 462
GLU A 539
PHE A 347
ALA A 292
ASP A 291
 None
SIA  A1692 ( 3.9A)
None
None
SIA  A1692 (-2.8A)
 1.37A 4wnuC-2bf6A:
undetectable		 4wnuC-2bf6A:
21.16
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.
2d3t 3-KETOACYL-COA
THIOLASE

(Pseudomonas
fragi) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLY C 346
LEU C 345
GLN C 244
ALA C 173
SER C 176
 None
 1.05A 4wnuC-2d3tC:
undetectable		 4wnuC-2d3tC:
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.
2dsj PYRIMIDINE-NUCLEOSID
E (THYMIDINE)
PHOSPHORYLASE

(Thermus
thermophilus) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 LEU A  71
GLY A 146
LEU A 147
ASP A  79
PHE A 305
 None
 1.35A 4wnuC-2dsjA:
undetectable		 4wnuC-2dsjA:
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.
2eid GALACTOSE OXIDASE

(Fusarium
graminearum) 		PF00754
(F5_F8_type_C)
PF01344
(Kelch_1)
PF09118
(DUF1929) 		5 PHE A 227
GLY A 288
GLN A 273
ALA A 247
SER A 291
 CU  A 640 (-4.4A)
None
None
None
None
 1.30A 4wnuC-2eidA:
undetectable		 4wnuC-2eidA:
21.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		6 LEU A 110
PHE A 120
GLY A 212
GLN A 244
ASP A 301
SER A 304
 None
HEM  A 600 (-4.6A)
None
None
None
None
 1.24A 4wnuC-2f9qA:
55.2		 4wnuC-2f9qA:
99.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		7 LEU A 110
PHE A 120
GLY A 212
PHE A 247
ALA A 300
ASP A 301
SER A 304
 None
HEM  A 600 (-4.6A)
None
None
None
None
None
 0.61A 4wnuC-2f9qA:
55.2		 4wnuC-2f9qA:
99.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		6 LEU A 248
PHE A 120
GLY A 212
GLN A 244
ASP A 301
SER A 304
 None
HEM  A 600 (-4.6A)
None
None
None
None
 1.47A 4wnuC-2f9qA:
55.2		 4wnuC-2f9qA:
99.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hbw NLP/P60 PROTEIN

(Trichormus
variabilis) 		PF00877
(NLPC_P60) 		5 LEU A 219
GLY A 178
LEU A 179
PHE A 167
ALA A 222
 None
 1.36A 4wnuC-2hbwA:
undetectable		 4wnuC-2hbwA:
18.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hpa PROTEIN (ACID
PHOSPHATASE)

(Homo sapiens) 		PF00328
(His_Phos_2) 		5 LEU A1283
GLY A1050
LEU A1091
PHE A1010
PHE A1092
 None
 1.36A 4wnuC-2hpaA:
undetectable		 4wnuC-2hpaA:
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.
2hpi DNA POLYMERASE III
ALPHA SUBUNIT

(Thermus
aquaticus) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		5 PHE A 813
GLY A 447
LEU A 448
GLU A 745
ALA A 692
 None
 1.30A 4wnuC-2hpiA:
undetectable		 4wnuC-2hpiA:
16.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jii SERINE/THREONINE-PRO
TEIN KINASE VRK3
MOLECULE: VACCINIA
RELATED KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 290
PHE A 296
GLY A 326
ALA A 240
PHE A 217
 None
 1.28A 4wnuC-2jiiA:
undetectable		 4wnuC-2jiiA:
22.29
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.
2jul CALSENILIN

(Mus musculus) 		PF13499
(EF-hand_7)
PF13833
(EF-hand_8) 		5 LEU A 134
GLU A 253
PHE A 122
ALA A 127
PHE A 252
 None
 1.36A 4wnuC-2julA:
undetectable		 4wnuC-2julA:
18.24
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.
2kbf ATP-DEPENDENT RNA
HELICASE DBP5

(Saccharomyces
cerevisiae) 		PF00271
(Helicase_C) 		5 GLY A 348
LEU A 350
GLU A 353
ALA A 315
ASP A 316
 None
 1.23A 4wnuC-2kbfA:
undetectable		 4wnuC-2kbfA:
16.08
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.
2toh TYROSINE
3-MONOOXYGENASE

(Rattus
norvegicus) 		PF00351
(Biopterin_H) 		5 PHE A 438
GLY A 335
LEU A 394
ALA A 341
ASP A 342
 None
 1.28A 4wnuC-2tohA:
undetectable		 4wnuC-2tohA:
23.02
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.
2v6j RNA HELICASE

(Kokobera virus) 		PF00271
(Helicase_C)
PF07652
(Flavi_DEAD) 		5 GLY A 114
LEU A 321
GLU A 325
ALA A 108
ASP A 106
 None
 1.32A 4wnuC-2v6jA:
undetectable		 4wnuC-2v6jA:
24.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v7s PROBABLE CONSERVED
LIPOPROTEIN LPPA

(Mycobacterium
tuberculosis) 		PF16708
(LppA) 		5 GLY A 127
PHE A 126
ALA A  78
ASP A  79
SER A  82
 GOL  A1208 (-3.3A)
None
None
None
None
 0.89A 4wnuC-2v7sA:
undetectable		 4wnuC-2v7sA:
17.01
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.
2w5o ALPHA-L-ARABINOFURAN
OSIDASE

(Fusarium
graminearum) 		no annotation 5 LEU A 130
GLY A  97
LEU A  98
SER A 124
PHE A  71
 None
 1.19A 4wnuC-2w5oA:
undetectable		 4wnuC-2w5oA:
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.
2wam CONSERVED
HYPOTHETICAL ALANINE
AND LEUCINE RICH
PROTEIN

(Mycobacterium
tuberculosis) 		PF09754
(PAC2) 		5 LEU A 229
PHE A  47
GLY A 208
ALA A  43
SER A 192
 None
 1.34A 4wnuC-2wamA:
undetectable		 4wnuC-2wamA:
22.59
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.
2wda PUTATIVE SECRETED
LYASE

(Streptomyces
violaceoruber) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		5 PHE A 401
GLY A 234
LEU A 235
ALA A 248
SER A 250
 None
 1.36A 4wnuC-2wdaA:
undetectable		 4wnuC-2wdaA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xfs ORF12

(Streptomyces
clavuligerus) 		PF13354
(Beta-lactamase2) 		5 LEU A 207
GLY A 279
LEU A 278
GLU A 277
ASP A 240
 None
 1.25A 4wnuC-2xfsA:
undetectable		 4wnuC-2xfsA:
22.77
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.
2xvg ALPHA XYLOSIDASE

(Cellvibrio
japonicus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		5 GLY A 151
GLU A 147
ALA A 402
ASP A 404
PHE A 174
 None
 1.14A 4wnuC-2xvgA:
undetectable		 4wnuC-2xvgA:
18.50
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.
2yut PUTATIVE SHORT-CHAIN
OXIDOREDUCTASE

(Thermus
thermophilus) 		PF00106
(adh_short) 		5 LEU A 171
GLY A 120
LEU A 141
PHE A 119
ALA A  73
 NAP  A 500 (-3.5A)
None
None
NAP  A 500 ( 4.4A)
NAP  A 500 (-4.1A)
 1.27A 4wnuC-2yutA:
undetectable		 4wnuC-2yutA:
21.89
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.
3a71 EXO-ARABINANASE

(Penicillium
chrysogenum) 		no annotation 5 LEU A 134
GLY A 101
LEU A 102
SER A 128
PHE A  75
 None
 1.18A 4wnuC-3a71A:
undetectable		 4wnuC-3a71A:
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.
3b02 TRANSCRIPTIONAL
REGULATOR, CRP
FAMILY

(Thermus
thermophilus) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		5 LEU A 181
GLY A 135
ALA A 124
ASP A 125
SER A 129
 None
 1.36A 4wnuC-3b02A:
undetectable		 4wnuC-3b02A:
18.30
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.
3cyj MANDELATE
RACEMASE/MUCONATE
LACTONIZING
ENZYME-LIKE PROTEIN

(Rubrobacter
xylanophilus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A 314
LEU A 350
GLU A 324
ALA A 304
PHE A 328
 None
 1.27A 4wnuC-3cyjA:
undetectable		 4wnuC-3cyjA:
24.24
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 LEU A 179
PHE A 169
GLY A 114
LEU A 113
ALA A 200
 None
 1.21A 4wnuC-3d1jA:
undetectable		 4wnuC-3d1jA:
24.27
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.
3e5m NMRA-LIKE FAMILY
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF05368
(NmrA) 		5 GLY A 113
LEU A 114
GLU A 115
ASP A 186
PHE A 130
 None
 1.26A 4wnuC-3e5mA:
undetectable		 4wnuC-3e5mA:
21.89
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.
3ezo MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Burkholderia
pseudomallei) 		PF00698
(Acyl_transf_1) 		5 GLY A 273
PHE A 295
ALA A 298
ASP A 301
PHE A   4
 None
 1.29A 4wnuC-3ezoA:
undetectable		 4wnuC-3ezoA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fgt PUTATIVE
PHOSPHOLIPASE B-LIKE
2 28 KDA FORM

(Mus musculus) 		PF04916
(Phospholip_B) 		5 LEU A  80
GLY A 124
LEU A 197
SER A 131
PHE A 219
 None
 1.36A 4wnuC-3fgtA:
undetectable		 4wnuC-3fgtA:
19.69
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.
3hqf RESTRICTION
ENDONUCLEASE

(Escherichia
coli) 		PF09217
(EcoRII-N) 		5 GLY A  39
LEU A  40
GLN A  37
ALA A  27
SER A  26
 None
 1.08A 4wnuC-3hqfA:
undetectable		 4wnuC-3hqfA:
15.96
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.
3k12 UNCHARACTERIZED
PROTEIN A6V7T0

(Pseudomonas
aeruginosa) 		PF01042
(Ribonuc_L-PSP) 		5 GLY A  28
GLU A  16
GLN A  29
ALA A  31
ASP A  32
 None
 1.38A 4wnuC-3k12A:
undetectable		 4wnuC-3k12A:
15.29
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.
3k9b LIVER
CARBOXYLESTERASE 1

(Homo sapiens) 		PF00135
(COesterase) 		5 LEU A1230
GLY A1223
GLU A1225
ALA A1243
SER A1245
 None
 1.12A 4wnuC-3k9bA:
undetectable		 4wnuC-3k9bA:
22.89
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.
3lpz GET4 (YOR164C
HOMOLOG)

(Chaetomium
thermophilum) 		PF04190
(DUF410) 		5 GLY A  62
LEU A  59
GLU A 104
ALA A  28
PHE A 100
 None
 1.20A 4wnuC-3lpzA:
undetectable		 4wnuC-3lpzA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m1c ENVELOPE
GLYCOPROTEIN H

(Human
alphaherpesvirus
2) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C) 		5 LEU A 531
GLY A 420
LEU A 421
ALA A 524
PHE A 363
 None
 1.35A 4wnuC-3m1cA:
undetectable		 4wnuC-3m1cA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mbr GLUTAMINE
CYCLOTRANSFERASE

(Xanthomonas
campestris) 		PF05096
(Glu_cyclase_2) 		5 LEU X  98
GLY X  88
GLN X 100
ALA X  80
SER X  65
 None
 1.38A 4wnuC-3mbrX:
undetectable		 4wnuC-3mbrX:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nyy PUTATIVE
GLYCYL-GLYCINE
ENDOPEPTIDASE LYTM

([Ruminococcus]
gnavus) 		PF01551
(Peptidase_M23) 		5 LEU A 250
GLY A 247
LEU A 246
ALA A 194
ASP A 117
 None
 1.36A 4wnuC-3nyyA:
undetectable		 4wnuC-3nyyA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o8s ADP-RIBOSE
PYROPHOSPHATASE

(Streptococcus
suis) 		PF00293
(NUDIX) 		5 GLY A 118
LEU A 119
GLU A 157
ALA A 166
SER A 167
 None
EDO  A 207 (-4.3A)
None
None
EDO  A 207 (-2.6A)
 1.33A 4wnuC-3o8sA:
undetectable		 4wnuC-3o8sA:
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.
3pve AGRIN, AGRIN PROTEIN

(Mus musculus) 		PF00054
(Laminin_G_1) 		5 LEU A1497
PHE A1523
GLY A1502
LEU A1580
ALA A1599
 None
 1.30A 4wnuC-3pveA:
undetectable		 4wnuC-3pveA:
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.
3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE

(Mycobacterium
marinum) 		PF13561
(adh_short_C2) 		5 LEU A   9
GLY A 228
LEU A 229
PHE A   7
ALA A 237
 None
 1.19A 4wnuC-3r1iA:
undetectable		 4wnuC-3r1iA:
22.32
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L

(Escherichia
coli) 		no annotation 5 LEU L 461
GLY L 383
LEU L 386
PHE L 379
ALA L 348
 None
 1.12A 4wnuC-3rkoL:
1.1		 4wnuC-3rkoL:
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.
3sqg METHYL COENZYME M
REDUCTASE, ALPHA
SUBUNIT
METHYL-COENZYME M
REDUCTASE, BETA
SUBUNIT

(uncultured
archaeon) 		PF02241
(MCR_beta)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
PF02783
(MCR_beta_N) 		5 LEU A 451
GLY B 350
LEU A 467
GLN A 470
ALA A 473
 None
None
GL3  A 464 ( 4.6A)
None
None
 1.31A 4wnuC-3sqgA:
undetectable		 4wnuC-3sqgA:
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.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 GLY A 290
LEU A 289
PHE A 610
ALA A 279
SER A 287
 None
 1.26A 4wnuC-3w9hA:
1.6		 4wnuC-3w9hA:
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.
3wod PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermus virus
P23-45) 		no annotation 5 LEU G  54
PHE G  13
GLY G  96
GLN G  92
ALA G  90
 None
 1.30A 4wnuC-3wodG:
undetectable		 4wnuC-3wodG:
14.68
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.
3woe PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermus virus
P23-45) 		no annotation 5 LEU B  54
PHE B  13
GLY B  96
GLN B  92
ALA B  90
 None
 1.28A 4wnuC-3woeB:
undetectable		 4wnuC-3woeB:
14.59
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.
3wy7 8-AMINO-7-OXONONANOA
TE SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00155
(Aminotran_1_2) 		5 LEU A 254
LEU A  89
GLU A  86
ALA A 107
PHE A  85
 None
 1.38A 4wnuC-3wy7A:
undetectable		 4wnuC-3wy7A:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a1o BIFUNCTIONAL PURINE
BIOSYNTHESIS PROTEIN
PURH

(Mycobacterium
tuberculosis) 		PF01808
(AICARFT_IMPCHas)
PF02142
(MGS) 		5 GLY A 478
LEU A 482
ALA A 471
ASP A 470
SER A 469
 None
None
None
K  A1524 (-3.6A)
None
 1.03A 4wnuC-4a1oA:
undetectable		 4wnuC-4a1oA:
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.
4c13 UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--L-LYSINE LIGASE

(Staphylococcus
aureus) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 GLY A 298
PHE A 300
ASP A 241
SER A 303
PHE A 281
 None
 1.19A 4wnuC-4c13A:
undetectable		 4wnuC-4c13A:
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.
4cnk L-AMINO ACID OXIDASE

(Streptococcus
cristatus) 		PF03486
(HI0933_like) 		5 PHE A 333
GLY A 325
LEU A 198
ALA A 192
PHE A 232
 FAD  A1392 (-4.2A)
None
None
None
None
 1.00A 4wnuC-4cnkA:
undetectable		 4wnuC-4cnkA:
22.03
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.
4d2j FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Toxoplasma
gondii) 		PF00274
(Glycolytic) 		5 LEU A 133
GLY A 373
GLU A 105
GLN A 377
ALA A 146
 None
SO4  A1418 (-3.4A)
None
None
None
 1.07A 4wnuC-4d2jA:
undetectable		 4wnuC-4d2jA:
21.93
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.
4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		5 PHE A 149
GLY A 320
GLU A 277
ALA A  96
ASP A  99
 None
 0.79A 4wnuC-4e4gA:
undetectable		 4wnuC-4e4gA:
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.
4itx CYSTATHIONINE
BETA-LYASE METC

(Escherichia
coli) 		PF01053
(Cys_Met_Meta_PP) 		5 PHE A 331
LEU A 277
ALA A 385
ASP A 386
PHE A 313
 None
 1.38A 4wnuC-4itxA:
undetectable		 4wnuC-4itxA:
23.33
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.
4iu4 ARGINASE

(Leishmania
mexicana) 		PF00491
(Arginase) 		5 LEU A 271
GLY A 189
LEU A 190
PHE A 209
ALA A 226
 None
 1.35A 4wnuC-4iu4A:
undetectable		 4wnuC-4iu4A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iu9 NITRITE EXTRUSION
PROTEIN 2

(Escherichia
coli) 		no annotation 5 PHE B 439
GLY B 354
ALA B 327
SER B 330
PHE B 352
 None
 1.19A 4wnuC-4iu9B:
undetectable		 4wnuC-4iu9B:
23.64
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.
4j5t MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE

(Saccharomyces
cerevisiae) 		PF03200
(Glyco_hydro_63)
PF16923
(Glyco_hydro_63N) 		5 LEU A 664
LEU A 693
PHE A 662
ALA A 725
ASP A 724
 None
 1.23A 4wnuC-4j5tA:
undetectable		 4wnuC-4j5tA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lfe GERANYLGERANYL
DIPHOSPHATE SYNTHASE

(Streptococcus
uberis) 		PF00348
(polyprenyl_synt) 		5 LEU A  80
PHE A  99
GLY A  73
LEU A 111
SER A  32
 None
 1.34A 4wnuC-4lfeA:
undetectable		 4wnuC-4lfeA:
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.
4nv2 VKORC1/THIOREDOXIN
DOMAIN PROTEIN

(Synechococcus
sp.
JA-2-3B'a(2-13)) 		PF07884
(VKOR) 		5 LEU A 107
GLY A  76
LEU A  77
ALA A  27
SER A  31
 None
U10  A 501 (-3.6A)
None
None
None
 1.21A 4wnuC-4nv2A:
undetectable		 4wnuC-4nv2A:
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.
4o6r ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		5 PHE A 154
GLY A 457
GLU A 459
GLN A 245
PHE A 448
 None
 1.38A 4wnuC-4o6rA:
undetectable		 4wnuC-4o6rA:
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.
4oe5 DELTA-1-PYRROLINE-5-
CARBOXYLATE
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00171
(Aldedh) 		5 LEU A 453
PHE A 320
GLY A 335
ALA A 350
SER A 510
 None
 0.98A 4wnuC-4oe5A:
undetectable		 4wnuC-4oe5A:
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.
4p8b TRAP-TYPE
TRANSPORTER,
PERIPLASMIC
COMPONENT

(Cupriavidus
necator) 		PF03480
(DctP) 		5 GLY A 213
LEU A 175
GLU A 215
GLN A 214
PHE A 187
 None
 1.09A 4wnuC-4p8bA:
undetectable		 4wnuC-4p8bA:
22.81
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.
4pc9 C4-DICARBOXYLATE
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN, PUTATIVE

(Roseobacter
denitrificans) 		PF03480
(DctP) 		5 LEU A 115
GLY A 271
LEU A 272
GLU A 269
SER A 276
 None
 1.11A 4wnuC-4pc9A:
undetectable		 4wnuC-4pc9A:
21.81
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.
4wlp NUCLEAR FACTOR
RELATED TO
KAPPA-B-BINDING
PROTEIN
UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE ISOZYME L5

(Homo sapiens) 		PF01088
(Peptidase_C12)
no annotation 		5 LEU B 146
PHE A 121
ALA A 123
ASP A 122
PHE A 114
 None
 1.38A 4wnuC-4wlpB:
undetectable		 4wnuC-4wlpB:
13.58
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.
4yr1 ALKALINE PHOSPHATASE

(Escherichia
coli) 		PF00245
(Alk_phosphatase) 		5 GLY A  74
LEU A 353
GLN A 350
ALA A 300
ASP A 304
 None
 1.28A 4wnuC-4yr1A:
undetectable		 4wnuC-4yr1A:
21.74
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.
5a1n BIFUNCTIONAL
GLUTAMATE/PROLINE--T
RNA LIGASE

(Homo sapiens) 		PF00043
(GST_C) 		5 LEU A  82
GLY A  16
LEU A  19
ALA A  59
PHE A 160
 None
 1.26A 4wnuC-5a1nA:
undetectable		 4wnuC-5a1nA:
18.03
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.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE

(Vesicular
stomatitis
virus) 		PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap) 		5 LEU A 616
PHE A 622
GLY A 759
LEU A 760
ALA A 387
 None
 1.23A 4wnuC-5a22A:
undetectable		 4wnuC-5a22A:
12.63
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.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 GLY A 290
LEU A 289
PHE A 610
ALA A 279
SER A 287
 None
 1.20A 4wnuC-5enoA:
undetectable		 4wnuC-5enoA:
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.
5erb POLYKETIDE SYNTHASE

(Bacillus
amyloliquefaciens) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A  24
GLY A  13
LEU A 254
ALA A 605
PHE A 206
 None
 1.35A 4wnuC-5erbA:
undetectable		 4wnuC-5erbA:
20.29
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.
5g6r IMINE REDUCTASE

(Aspergillus
oryzae) 		PF03446
(NAD_binding_2) 		5 GLY A 117
LEU A 133
ALA A 162
ASP A 161
SER A 135
 None
 1.11A 4wnuC-5g6rA:
undetectable		 4wnuC-5g6rA:
21.55
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.
5gn5 GLYCEROL KINASE

(Trypanosoma
brucei) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 PHE A 140
GLY A 300
GLU A 314
GLN A 256
ALA A 190
 None
None
6XZ  A 601 (-3.5A)
None
None
 1.18A 4wnuC-5gn5A:
undetectable		 4wnuC-5gn5A:
20.70
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.
5hdm GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
1, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00202
(Aminotran_3) 		5 LEU A 431
GLY A 343
LEU A 340
ALA A 426
PHE A 364
 None
 1.34A 4wnuC-5hdmA:
undetectable		 4wnuC-5hdmA:
22.09
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.
5joz NON-REDUCING END
ALPHA-L-ARABINOFURAN
OSIDASE BOGH43B

(Bacteroides
ovatus) 		PF04616
(Glyco_hydro_43) 		5 LEU A  61
GLY A  96
GLN A  97
PHE A  55
ALA A  99
 None
 1.37A 4wnuC-5jozA:
undetectable		 4wnuC-5jozA:
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.
5o8x SOLUBLE LYTIC
TRANSGLYCOSYLASE B

(Pseudomonas
aeruginosa) 		no annotation 5 LEU A 146
GLY A 166
PHE A 170
ALA A 179
SER A 200
 None
 1.28A 4wnuC-5o8xA:
undetectable		 4wnuC-5o8xA:
12.13
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.
5oc9 -

(-) 		no annotation 5 LEU A 258
GLY A 506
LEU A 510
PHE A 502
ALA A 558
 None
None
None
None
79M  A 711 ( 4.3A)
 1.31A 4wnuC-5oc9A:
undetectable		 4wnuC-5oc9A:
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.
5ojl IMINE REDUCTASE

(Aspergillus
terreus) 		no annotation 5 GLY A 122
LEU A 138
ALA A 168
ASP A 167
SER A 140
 None
 1.16A 4wnuC-5ojlA:
undetectable		 4wnuC-5ojlA:
9.63
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.
5td6 FOG-3 PROTEIN

(Caenorhabditis
elegans) 		PF07742
(BTG) 		5 PHE A  11
GLY A  33
LEU A  32
PHE A  40
ALA A  92
 None
 1.12A 4wnuC-5td6A:
undetectable		 4wnuC-5td6A:
13.99
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.
5vn5 2,2',3-TRIHYDROXY-3'
-METHOXY-5,5'-DICARB
OXYBIPHENYL
META-CLEAVAGE
COMPOUND HYDROLASE

(Sphingobium sp.
SYK-6) 		PF04909
(Amidohydro_2) 		5 LEU A  59
GLY A   7
GLN A  67
ALA A  45
SER A  10
 None
 1.23A 4wnuC-5vn5A:
undetectable		 4wnuC-5vn5A:
18.72
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.
5w1e PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		no annotation 5 LEU A 211
GLY A 150
LEU A 152
ALA A 218
SER A 220
 None
None
None
PHB  A 602 (-3.6A)
PHB  A 602 ( 4.6A)
 1.34A 4wnuC-5w1eA:
undetectable		 4wnuC-5w1eA:
11.67
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.
5wrr PSEUDOKINASE FAM20A

(Homo sapiens) 		PF06702
(Fam20C) 		5 PHE A 275
GLY A 407
PHE A 435
ALA A 266
ASP A 270
 None
 1.21A 4wnuC-5wrrA:
undetectable		 4wnuC-5wrrA:
24.06
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.
5xqh PROTEIN ROGDI
HOMOLOG

(Homo sapiens) 		PF10259
(Rogdi_lz) 		5 GLY A  79
LEU A  77
PHE A  45
ALA A 257
ASP A 256
 None
 1.28A 4wnuC-5xqhA:
undetectable		 4wnuC-5xqhA:
18.87
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.
5xqo PCRGLX PROTEIN

(Penicillium
chrysogenum) 		no annotation 5 LEU A 789
PHE A 706
GLY A 750
LEU A 747
SER A 755
 None
 0.94A 4wnuC-5xqoA:
undetectable		 4wnuC-5xqoA:
9.19
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		5 LEU C 662
GLY C 769
LEU C 773
GLU C 775
SER C 735
 None
 1.34A 4wnuC-5y3rC:
undetectable		 4wnuC-5y3rC:
7.59
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.
5yh0 DRFAM20C1

(Danio rerio) 		no annotation 5 PHE A 299
GLY A 431
PHE A 459
ALA A 290
ASP A 294
 None
 1.20A 4wnuC-5yh0A:
undetectable		 4wnuC-5yh0A:
10.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yh3 EXTRACELLULAR
SERINE/THREONINE
PROTEIN KINASE
FAM20C

(Homo sapiens) 		no annotation 5 PHE C 323
GLY C 455
PHE C 483
ALA C 314
ASP C 318
 None
 1.23A 4wnuC-5yh3C:
undetectable		 4wnuC-5yh3C:
13.67
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.
5zgb LHCR1
LHCR2

(Cyanidioschyzon
merolae) 		no annotation 5 LEU 1   6
PHE 1  30
GLY 2 121
LEU 2 122
PHE 2 118
 CLA  1 601 (-4.0A)
CLA  1 602 ( 3.7A)
None
CLA  2 607 ( 4.8A)
None
 1.07A 4wnuC-5zgb1:
undetectable		 4wnuC-5zgb1:
10.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zgb LHCR1
LHCR2

(Cyanidioschyzon
merolae) 		no annotation 5 PHE 1  30
GLY 2 121
LEU 2 122
ASP 1  26
PHE 2 118
 CLA  1 602 ( 3.7A)
None
CLA  2 607 ( 4.8A)
CLA  1 602 ( 3.2A)
None
 1.35A 4wnuC-5zgb1:
undetectable		 4wnuC-5zgb1:
10.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6byx SHORT ULVAN LYASE

(Alteromonas sp.
LOR) 		no annotation 5 GLY A 301
LEU A 302
ASP A 364
SER A 363
PHE A 317
 None
None
GOL  A 614 (-2.6A)
GOL  A 614 ( 4.7A)
None
 1.37A 4wnuC-6byxA:
undetectable		 4wnuC-6byxA:
10.66
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.
6c9k DARP14 - SUBUNIT A
WITH DARPIN

(synthetic
construct) 		no annotation 5 GLY A 187
LEU A 164
ALA A 113
ASP A 116
SER A 112
 None
 1.23A 4wnuC-6c9kA:
undetectable		 4wnuC-6c9kA:
11.57
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.
6d21 FERM, RHOGEF AND
PLECKSTRIN DOMAIN
PROTEIN 2

(Danio rerio) 		no annotation 5 LEU A 123
GLY A  57
LEU A  58
GLN A  56
SER A 127
 None
 1.02A 4wnuC-6d21A:
undetectable		 4wnuC-6d21A:
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.
6d8d HEMAGGLUTININ HA2
CHAIN

(Influenza A
virus) 		no annotation 5 GLY B 134
GLU B 132
ALA B   5
ASP B 116
PHE B 138
 None
 1.05A 4wnuC-6d8dB:
undetectable		 4wnuC-6d8dB:
11.37