SIMILAR PATTERNS OF AMINO ACIDS FOR 5ESK_A_1YNA701_2

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.
1bru ELASTASE

(Sus scrofa) 		PF00089
(Trypsin) 		4 ALA P 183
PRO P 198
LEU P 123
HIS P 210
 None
 1.48A 5eskA-1bruP:
undetectable		 5eskA-1bruP:
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.
1c9e PROTOHEME FERROLYASE

(Bacillus
subtilis) 		PF00762
(Ferrochelatase) 		4 ALA A 292
PRO A  55
LEU A 263
HIS A 262
 None
None
MP1  A 800 ( 4.5A)
None
 1.44A 5eskA-1c9eA:
undetectable		 5eskA-1c9eA:
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.
1ct9 ASPARAGINE
SYNTHETASE B

(Escherichia
coli) 		PF00733
(Asn_synthase)
PF13537
(GATase_7) 		4 ALA A 338
PRO A 228
LEU A 267
HIS A 268
 None
 1.48A 5eskA-1ct9A:
0.0		 5eskA-1ct9A:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fno PEPTIDASE T

(Salmonella
enterica) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 ALA A  72
PRO A 367
LEU A 333
HIS A 331
 None
 1.37A 5eskA-1fnoA:
0.0		 5eskA-1fnoA:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h3g CYCLOMALTODEXTRINASE

(Flavobacterium
sp. 92) 		PF00128
(Alpha-amylase)
PF09087
(Cyc-maltodext_N)
PF10438
(Cyc-maltodext_C) 		4 ALA A 175
PRO A 169
LEU A 221
HIS A 223
 None
 1.26A 5eskA-1h3gA:
0.0		 5eskA-1h3gA:
21.35
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.
1j1w ISOCITRATE
DEHYDROGENASE

(Azotobacter
vinelandii) 		PF03971
(IDH) 		4 ALA A  16
PRO A  24
LEU A 663
HIS A 660
 None
 1.36A 5eskA-1j1wA:
undetectable		 5eskA-1j1wA:
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.
1jj7 PEPTIDE TRANSPORTER
TAP1

(Homo sapiens) 		PF00005
(ABC_tran) 		4 ALA A 652
PRO A 661
LEU A 577
HIS A 578
 None
 1.22A 5eskA-1jj7A:
0.0		 5eskA-1jj7A:
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.
1jsx GLUCOSE-INHIBITED
DIVISION PROTEIN B

(Escherichia
coli) 		PF02527
(GidB) 		4 ALA A 140
PRO A  76
LEU A  50
HIS A  53
 None
 1.47A 5eskA-1jsxA:
0.0		 5eskA-1jsxA:
17.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m33 BIOH PROTEIN

(Escherichia
coli) 		PF00561
(Abhydrolase_1) 		4 ALA A 167
PRO A 171
LEU A  83
HIS A  20
 None
None
3OH  A 300 (-4.2A)
None
 1.47A 5eskA-1m33A:
0.0		 5eskA-1m33A:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s2n EXTRACELLULAR
SUBTILISIN-LIKE
SERINE PROTEINASE

(Vibrio sp.
PA-44) 		PF00082
(Peptidase_S8) 		4 ALA A 207
PRO A 224
LEU A 129
HIS A  70
 None
None
None
PMS  A1284 (-4.1A)
 1.29A 5eskA-1s2nA:
undetectable		 5eskA-1s2nA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sb3 4-HYDROXYBENZOYL-COA
REDUCTASE ALPHA
SUBUNIT

(Thauera
aromatica) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 ALA A  94
PRO A 353
LEU A 156
HIS A 148
 None
 1.27A 5eskA-1sb3A:
undetectable		 5eskA-1sb3A:
21.77
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.
1shz RHO GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 1

(Homo sapiens) 		PF09128
(RGS-like) 		4 ALA C 108
PRO C  72
LEU C  79
HIS C  80
 None
 1.34A 5eskA-1shzC:
1.6		 5eskA-1shzC:
19.27
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.
1ycg NITRIC OXIDE
REDUCTASE

(Moorella
thermoacetica) 		PF00258
(Flavodoxin_1)
PF00753
(Lactamase_B) 		4 ALA A  28
PRO A 202
LEU A 147
HIS A 148
 None
None
None
FEO  A 501 (-2.8A)
 1.27A 5eskA-1ycgA:
undetectable		 5eskA-1ycgA:
22.79
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.
2dfa HYPOTHETICAL UPF0271
PROTEIN TTHB195

(Thermus
thermophilus) 		PF03746
(LamB_YcsF) 		4 ALA A   9
PRO A  63
LEU A 141
HIS A 107
 None
 1.37A 5eskA-2dfaA:
undetectable		 5eskA-2dfaA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hnh DNA POLYMERASE III
ALPHA SUBUNIT

(Escherichia
coli) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		4 ALA A  33
PRO A  37
LEU A   9
HIS A   8
 None
 1.49A 5eskA-2hnhA:
3.3		 5eskA-2hnhA:
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.
2hp3 IDS-EPIMERASE

(Agrobacterium
tumefaciens) 		PF03972
(MmgE_PrpD) 		4 ALA A 279
PRO A 403
LEU A 409
HIS A 408
 None
None
None
EDO  A1010 ( 3.8A)
 1.25A 5eskA-2hp3A:
undetectable		 5eskA-2hp3A:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ja2 GLUTAMYL-TRNA
SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00749
(tRNA-synt_1c) 		4 ALA A 166
PRO A 242
LEU A 213
HIS A 246
 None
 1.17A 5eskA-2ja2A:
undetectable		 5eskA-2ja2A:
23.52
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.
2p2c CASPASE-2

(Homo sapiens) 		PF00656
(Peptidase_C14)
PF12796
(Ank_2)
PF13637
(Ank_4) 		4 ALA P 141
PRO B 275
LEU P  86
HIS P  85
 None
 1.33A 5eskA-2p2cP:
undetectable		 5eskA-2p2cP:
16.57
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.
2p6r AFUHEL308 HELICASE

(Archaeoglobus
fulgidus) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		4 ALA A 333
PRO A  76
LEU A 150
HIS A 148
 None
 1.19A 5eskA-2p6rA:
1.4		 5eskA-2p6rA:
22.75
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.
2rg2 CHOLOYLGLYCINE
HYDROLASE

(Clostridium
perfringens) 		PF02275
(CBAH) 		4 ALA A 226
PRO A  84
LEU A 142
HIS A 143
 None
GOL  A 336 (-4.2A)
EDO  A 333 ( 4.5A)
None
 1.47A 5eskA-2rg2A:
undetectable		 5eskA-2rg2A:
21.69
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.
2v8j PECTATE LYASE

(Yersinia
enterocolitica) 		PF06917
(Pectate_lyase_2) 		4 ALA A 204
PRO A 136
LEU A 104
HIS A 129
 None
 1.48A 5eskA-2v8jA:
undetectable		 5eskA-2v8jA:
22.00
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.
2vc2 INTEGRIN ALPHA-IIB

(Homo sapiens) 		PF01839
(FG-GAP)
PF13517
(VCBS) 		4 ALA A 361
PRO A 379
LEU A 312
HIS A 291
 None
 1.20A 5eskA-2vc2A:
undetectable		 5eskA-2vc2A:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vpw HYPOTHETICAL
MEMBRANE SPANNING
PROTEIN

(Thermus
thermophilus) 		PF14589
(NrfD_2) 		4 ALA C  10
PRO C 142
LEU C 202
HIS C 201
 None
 1.25A 5eskA-2vpwC:
undetectable		 5eskA-2vpwC:
18.73
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.
2x7v PROBABLE
ENDONUCLEASE 4

(Thermotoga
maritima) 		PF01261
(AP_endonuc_2) 		4 ALA A 174
PRO A 256
LEU A 216
HIS A 215
 None
None
None
ZN  A1288 (-3.3A)
 1.36A 5eskA-2x7vA:
undetectable		 5eskA-2x7vA:
20.37
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.
2xy9 ANGIOTENSIN-CONVERTI
NG ENZYME

(Homo sapiens) 		PF01401
(Peptidase_M2) 		4 ALA A 272
PRO A 459
LEU A 245
HIS A 248
 None
 1.20A 5eskA-2xy9A:
undetectable		 5eskA-2xy9A:
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.
2xyd ANGIOTENSIN-CONVERTI
NG ENZYME

(Homo sapiens) 		PF01401
(Peptidase_M2) 		4 ALA A 250
PRO A 437
LEU A 223
HIS A 226
 None
 1.12A 5eskA-2xydA:
undetectable		 5eskA-2xydA:
20.55
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.
2ywg GTP-BINDING PROTEIN
LEPA

(Aquifex
aeolicus) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF06421
(LepA_C) 		4 ALA A 195
PRO A 185
LEU A  75
HIS A  76
 None
 1.38A 5eskA-2ywgA:
undetectable		 5eskA-2ywgA:
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.
3afg SUBTILISIN-LIKE
SERINE PROTEASE

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8)
PF04151
(PPC) 		4 ALA A 337
PRO A 363
LEU A 248
HIS A 180
 None
 1.21A 5eskA-3afgA:
undetectable		 5eskA-3afgA:
20.57
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.
3ahy BETA-GLUCOSIDASE

(Trichoderma
reesei) 		PF00232
(Glyco_hydro_1) 		4 ALA A 284
PRO A 257
LEU A 275
HIS A 194
 None
 1.21A 5eskA-3ahyA:
undetectable		 5eskA-3ahyA:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bc9 ALPHA AMYLASE,
CATALYTIC REGION

(Halothermothrix
orenii) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 ALA A 177
PRO A 171
LEU A 231
HIS A 233
 None
None
None
ACI  A 806 (-4.4A)
 1.11A 5eskA-3bc9A:
undetectable		 5eskA-3bc9A:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eo7 PUTATIVE
NITROREDUCTASE

(Trichormus
variabilis) 		PF00881
(Nitroreductase) 		4 ALA A 200
PRO A 359
LEU A 462
HIS A 461
 None
 0.88A 5eskA-3eo7A:
undetectable		 5eskA-3eo7A:
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.
3lat BIFUNCTIONAL
AUTOLYSIN

(Staphylococcus
epidermidis) 		PF01510
(Amidase_2) 		4 ALA A 140
PRO A  54
LEU A 103
HIS A  86
 None
 1.40A 5eskA-3latA:
undetectable		 5eskA-3latA:
18.61
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.
3lpd ACIDIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE APRV2

(Dichelobacter
nodosus) 		PF00082
(Peptidase_S8) 		4 ALA A  75
PRO A 134
LEU A  45
HIS A  46
 None
 1.33A 5eskA-3lpdA:
0.1		 5eskA-3lpdA:
19.06
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.
3mca ELONGATION FACTOR 1
ALPHA-LIKE PROTEIN

(Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3) 		4 ALA A 427
PRO A 396
LEU A 180
HIS A 179
 None
 1.19A 5eskA-3mcaA:
undetectable		 5eskA-3mcaA:
22.97
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.
3pb9 GLUTAMINYL-PEPTIDE
CYCLOTRANSFERASE-LIK
E PROTEIN

(Homo sapiens) 		PF04389
(Peptidase_M28) 		4 ALA X 244
PRO X 337
LEU X 163
HIS X 162
 None
 1.31A 5eskA-3pb9X:
undetectable		 5eskA-3pb9X:
21.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pfm GGDEF DOMAIN PROTEIN

(Pseudomonas
protegens) 		PF00563
(EAL) 		4 ALA A 616
PRO A 432
LEU A 496
HIS A 444
 None
 1.28A 5eskA-3pfmA:
undetectable		 5eskA-3pfmA:
18.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pju CYCLIC DIMERIC GMP
BINDING PROTEIN

(Pseudomonas
fluorescens) 		PF00563
(EAL) 		4 ALA A 616
PRO A 432
LEU A 496
HIS A 444
 None
 1.30A 5eskA-3pjuA:
undetectable		 5eskA-3pjuA:
18.91
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.
3pjx CYCLIC DIMERIC GMP
BINDING PROTEIN

(Pseudomonas
fluorescens) 		PF00563
(EAL)
PF00990
(GGDEF) 		4 ALA A 616
PRO A 432
LEU A 496
HIS A 444
 None
None
None
EDO  A 651 (-4.0A)
 1.29A 5eskA-3pjxA:
undetectable		 5eskA-3pjxA:
20.76
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.
3shd PHOSPHATASE NUDJ

(Escherichia
coli) 		PF00293
(NUDIX) 		4 ALA A  73
PRO A   4
LEU A  38
HIS A  37
 None
None
None
SO4  A 156 (-3.9A)
 1.47A 5eskA-3shdA:
undetectable		 5eskA-3shdA:
14.07
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.
4bxs VENOM PROTHROMBIN
ACTIVATOR
PSEUTARIN-C
NON-CATALYTIC
SUBUNIT

(Pseudonaja
textilis) 		PF00754
(F5_F8_type_C)
PF07732
(Cu-oxidase_3) 		4 ALA V 398
PRO V 495
LEU V 585
HIS V 584
 None
 1.47A 5eskA-4bxsV:
undetectable		 5eskA-4bxsV:
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.
4bxs VENOM PROTHROMBIN
ACTIVATOR
PSEUTARIN-C
NON-CATALYTIC
SUBUNIT

(Pseudonaja
textilis) 		PF00754
(F5_F8_type_C)
PF07732
(Cu-oxidase_3) 		4 ALA V 940
PRO V 947
LEU V 635
HIS V 598
 None
 1.13A 5eskA-4bxsV:
undetectable		 5eskA-4bxsV:
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.
4dzt AQUALYSIN-1

(Thermus
aquaticus) 		PF00082
(Peptidase_S8) 		4 ALA A 207
PRO A 226
LEU A 129
HIS A  70
 None
None
None
PMS  A 301 (-4.2A)
 1.18A 5eskA-4dztA:
undetectable		 5eskA-4dztA:
20.24
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.
4gxp BETA-GLUCOSIDASE
CHIMERIC PROTEIN

(Thermotoga
maritima;
Trichoderma
reesei) 		PF00232
(Glyco_hydro_1) 		4 ALA A 288
PRO A 261
LEU A 279
HIS A 202
 None
 1.21A 5eskA-4gxpA:
undetectable		 5eskA-4gxpA:
20.56
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.
4h3v OXIDOREDUCTASE
DOMAIN PROTEIN

(Kribbella
flavida) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ALA A 124
PRO A 356
LEU A  75
HIS A  98
 None
 1.28A 5eskA-4h3vA:
undetectable		 5eskA-4h3vA:
22.69
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.
4ilt INTRADIOL
RING-CLEAVAGE
DIOXYGENASE

(Streptomyces
sp. SirexAA-E) 		PF00775
(Dioxygenase_C) 		4 ALA A 137
PRO A  86
LEU A 203
HIS A 173
 None
None
None
FE  A 301 (-3.1A)
 1.18A 5eskA-4iltA:
undetectable		 5eskA-4iltA:
13.82
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.
4ilv INTRADIOL
RING-CLEAVAGE
DIOXYGENASE

(Streptomyces
sp. SirexAA-E) 		PF00775
(Dioxygenase_C) 		4 ALA A 137
PRO A  86
LEU A 203
HIS A 173
 None
EDO  A 302 (-4.4A)
None
FE  A 301 ( 3.3A)
 1.14A 5eskA-4ilvA:
undetectable		 5eskA-4ilvA:
18.76
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.
4knk BIFUNCTIONAL
AUTOLYSIN

(Staphylococcus
aureus) 		PF01510
(Amidase_2) 		4 ALA A 345
PRO A 259
LEU A 308
HIS A 291
 None
 1.41A 5eskA-4knkA:
undetectable		 5eskA-4knkA:
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.
4mdp BETA-GLUCOSIDASE

(Humicola grisea) 		PF00232
(Glyco_hydro_1) 		4 ALA A 294
PRO A 267
LEU A 285
HIS A 205
 None
None
None
PEG  A 504 ( 4.9A)
 1.46A 5eskA-4mdpA:
undetectable		 5eskA-4mdpA:
21.72
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.
4n9w GDP-MANNOSE-DEPENDEN
T
ALPHA-(1-2)-PHOSPHAT
IDYLINOSITOL
MANNOSYLTRANSFERASE

(Mycolicibacterium
smegmatis) 		PF13439
(Glyco_transf_4)
PF13692
(Glyco_trans_1_4) 		4 ALA A 146
PRO A  96
LEU A  91
HIS A  92
 None
 1.24A 5eskA-4n9wA:
undetectable		 5eskA-4n9wA:
22.98
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.
4r0k DIPEPTIDYL-PEPTIDASE
VI

(Bacteroides
thetaiotaomicron) 		PF00877
(NLPC_P60) 		4 ALA A  32
PRO A  62
LEU A 326
HIS A 328
 None
 1.35A 5eskA-4r0kA:
undetectable		 5eskA-4r0kA:
19.71
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.
4r3u 2-HYDROXYISOBUTYRYL-
COA MUTASE LARGE
SUBUNIT
2-HYDROXYISOBUTYRYL-
COA MUTASE SMALL
SUBUNIT

(Aquincola
tertiaricarbonis) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding) 		4 ALA A 207
PRO A 170
LEU C  15
HIS C  42
 None
 1.33A 5eskA-4r3uA:
undetectable		 5eskA-4r3uA:
22.88
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.
4zhj MG-CHELATASE SUBUNIT
CHLH

(Synechocystis
sp. PCC 6803) 		PF02514
(CobN-Mg_chel)
PF11965
(DUF3479) 		4 ALA A 942
PRO A 921
LEU A 347
HIS A 356
 None
 1.34A 5eskA-4zhjA:
undetectable		 5eskA-4zhjA:
17.76
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.
4zr8 UROPORPHYRINOGEN
DECARBOXYLASE

(Acinetobacter
baumannii) 		PF01208
(URO-D) 		4 ALA A 117
PRO A  82
LEU A 181
HIS A 184
 None
None
None
MG  A 401 ( 4.8A)
 1.49A 5eskA-4zr8A:
undetectable		 5eskA-4zr8A:
21.73
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.
4zz7 METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Oceanimonas
doudoroffii) 		PF00171
(Aldedh) 		4 ALA A 185
PRO A 178
LEU A  36
HIS A   6
 None
 1.41A 5eskA-4zz7A:
undetectable		 5eskA-4zz7A:
20.90
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.
5ci5 EXTRACELLULAR
SOLUTE-BINDING
PROTEIN FAMILY 1

(Pseudothermotoga
lettingae) 		PF13416
(SBP_bac_8) 		4 ALA A 166
PRO A 155
LEU A 137
HIS A 285
 None
 1.43A 5eskA-5ci5A:
undetectable		 5eskA-5ci5A:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5csc CITRATE SYNTHASE

(Gallus gallus) 		PF00285
(Citrate_synt) 		4 ALA B 414
PRO B 418
LEU B 250
HIS B 249
 None
 1.40A 5eskA-5cscB:
undetectable		 5eskA-5cscB:
23.31
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.
5cxc RIBOSOME BIOGENESIS
PROTEIN ERB1

(Chaetomium
thermophilum) 		PF00400
(WD40) 		4 ALA B 639
PRO B 628
LEU B 624
HIS B 618
 None
 1.41A 5eskA-5cxcB:
undetectable		 5eskA-5cxcB:
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.
5dne L-ASPARAGINASE

(Cavia porcellus) 		PF00710
(Asparaginase) 		4 ALA A  53
PRO A  64
LEU A  39
HIS A  46
 None
 1.47A 5eskA-5dneA:
undetectable		 5eskA-5dneA:
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.
5f56 SINGLE-STRANDED-DNA-
SPECIFIC EXONUCLEASE

(Deinococcus
radiodurans) 		PF01368
(DHH)
PF02272
(DHHA1) 		4 ALA A 400
PRO A 226
LEU A 187
HIS A 159
 None
None
None
MN  A 805 (-3.4A)
 1.49A 5eskA-5f56A:
0.8		 5eskA-5f56A:
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.
5fku DNA POLYMERASE III
SUBUNIT ALPHA

(Escherichia
coli) 		PF01336
(tRNA_anti-codon)
PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		4 ALA A  33
PRO A  37
LEU A   9
HIS A   8
 None
 1.48A 5eskA-5fkuA:
2.9		 5eskA-5fkuA:
19.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fsa CYP51 VARIANT1

(Candida
albicans) 		PF00067
(p450) 		4 ALA A  61
PRO A 230
LEU A 376
HIS A 377
 X2N  A 590 (-3.5A)
X2N  A 590 (-4.2A)
X2N  A 590 (-4.3A)
X2N  A 590 (-4.3A)
 0.44A 5eskA-5fsaA:
56.0		 5eskA-5fsaA:
59.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hs1 LANOSTEROL 14-ALPHA
DEMETHYLASE

(Saccharomyces
cerevisiae) 		PF00067
(p450) 		4 ALA A  69
PRO A 238
LEU A 380
HIS A 381
 None
None
VOR  A 602 (-4.0A)
None
 0.58A 5eskA-5hs1A:
63.2		 5eskA-5hs1A:
99.81
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.
5jbk BETA-GLUCOSIDASE

(Trichoderma
harzianum) 		PF00232
(Glyco_hydro_1) 		4 ALA A 284
PRO A 257
LEU A 275
HIS A 195
 None
 1.20A 5eskA-5jbkA:
undetectable		 5eskA-5jbkA:
20.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jlc LANOSTEROL 14-ALPHA
DEMETHYLASE

([Candida]
glabrata) 		PF00067
(p450) 		4 ALA A  70
PRO A 239
LEU A 381
HIS A 382
 1YN  A 602 (-3.4A)
1YN  A 602 ( 4.8A)
1YN  A 602 ( 4.7A)
1YN  A 602 (-4.2A)
 0.28A 5eskA-5jlcA:
57.6		 5eskA-5jlcA:
83.88
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.
5ko5 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Schistosoma
mansoni) 		PF01048
(PNP_UDP_1) 		4 ALA A 119
PRO A 225
LEU A  87
HIS A  88
 None
None
None
EDO  A 302 (-4.5A)
 1.19A 5eskA-5ko5A:
undetectable		 5eskA-5ko5A:
22.07
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.
5m04 GTPASE OBGE/CGTA

(Escherichia
coli) 		PF01018
(GTP1_OBG)
PF01926
(MMR_HSR1) 		4 ALA A 274
PRO A 215
LEU A 244
HIS A 243
 None
 1.36A 5eskA-5m04A:
undetectable		 5eskA-5m04A:
20.90
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.
5nla PUTATIVE
TRANSCRIPTIONAL
REGULATOR
TRANSCRIPTION
REGULATOR PROTEIN

(Sinorhizobium
meliloti) 		PF12833
(HTH_18)
PF14525
(AraC_binding_2) 		4 ALA A 167
PRO A  86
LEU A  75
HIS A 107
 None
 1.45A 5eskA-5nlaA:
undetectable		 5eskA-5nlaA:
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.
5ny5 3,4-DIHYDROXYBENZOAT
E DECARBOXYLASE

(Enterobacter
cloacae) 		PF01977
(UbiD) 		4 ALA A 186
PRO A 302
LEU A 172
HIS A 170
 None
 1.35A 5eskA-5ny5A:
undetectable		 5eskA-5ny5A:
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.
5wsl KERATINASE

(Meiothermus
taiwanensis) 		no annotation 4 ALA A 209
PRO A 228
LEU A 131
HIS A  72
 None
 1.31A 5eskA-5wslA:
undetectable		 5eskA-5wslA:
20.40
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.
5xtc NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
2

(Homo sapiens) 		no annotation 4 ALA i 192
PRO i 262
LEU i 211
HIS i 186
 None
 1.46A 5eskA-5xtci:
undetectable		 5eskA-5xtci:
21.34
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.
5y6q ALDEHYDE OXIDASE
LARGE SUBUNIT

(Methylobacillus
sp. KY4400) 		no annotation 4 ALA C 217
PRO C 229
LEU C 299
HIS C 271
 None
 1.42A 5eskA-5y6qC:
undetectable		 5eskA-5y6qC:
8.94
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.
6d14 TNF
RECEPTOR-ASSOCIATED
PROTEIN 1

(Danio rerio) 		no annotation 4 ALA A 154
PRO A 299
LEU A 160
HIS A 159
 None
 1.35A 5eskA-6d14A:
undetectable		 5eskA-6d14A:
10.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 4 ALA B 231
PRO B 392
LEU B 389
HIS B 387
 None
 1.32A 5eskA-6f0kB:
undetectable		 5eskA-6f0kB:
9.94
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.
6f72 MTVAO615

(Thermothelomyces
thermophila) 		no annotation 4 ALA A 493
PRO A 411
LEU A 160
HIS A 522
 None
 1.15A 5eskA-6f72A:
undetectable		 5eskA-6f72A:
9.94
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.
6fb3 TENEURIN-2

(Gallus gallus) 		no annotation 4 ALA A1449
PRO A1323
LEU A1024
HIS A1512
 None
 1.47A 5eskA-6fb3A:
undetectable		 5eskA-6fb3A:
10.25
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.
6fth EXTRACELLULAR
SOLUTE-BINDING
PROTEIN, FAMILY 1

(Bifidobacterium
longum) 		no annotation 4 ALA A  61
PRO A  28
LEU A 395
HIS A  79
 None
 1.43A 5eskA-6fthA:
undetectable		 5eskA-6fthA:
10.41
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.
6g43 PUTATIVE MAJOR
CAPSID PROTEIN

(Cafeteriavirus-dependent
mavirus) 		no annotation 4 ALA A  68
PRO A 287
LEU A 125
HIS A 126
 None
 1.22A 5eskA-6g43A:
undetectable		 5eskA-6g43A:
9.80
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.
6g45 PUTATIVE MAJOR
CAPSID PROTEIN

(Cafeteriavirus-dependent
mavirus) 		no annotation 4 ALA A  68
PRO A 287
LEU A 125
HIS A 126
 None
 1.23A 5eskA-6g45A:
undetectable		 5eskA-6g45A:
9.80