SIMILAR PATTERNS OF AMINO ACIDS FOR 1UAK_A_SAMA301

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.
1c4x PROTEIN
(2-HYDROXY-6-OXO-6-P
HENYLHEXA-2,4-DIENOA
TE HYDROLASE)

(Rhodococcus
jostii) 		PF12697
(Abhydrolase_6) 		5 LEU A 132
ILE A 106
LEU A  34
GLY A 112
GLY A 113
 None
 0.89A 1uakA-1c4xA:
undetectable		 1uakA-1c4xA:
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.
1cbf COBALT-PRECORRIN-4
TRANSMETHYLASE

(Bacillus
megaterium) 		PF00590
(TP_methylase) 		6 LEU A  35
GLY A 129
VAL A 133
GLY A 102
GLY A  29
PRO A  30
 None
None
None
SAH  A 300 (-3.5A)
None
SAH  A 300 (-4.9A)
 1.29A 1uakA-1cbfA:
undetectable		 1uakA-1cbfA:
26.96
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.
1dl5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01135
(PCMT) 		5 SER A  58
GLY A  87
ILE A 206
GLY A  84
GLY A  85
 SAH  A 699 ( 4.9A)
SAH  A 699 ( 4.8A)
SAH  A 699 ( 4.6A)
SAH  A 699 (-4.2A)
SAH  A 699 (-3.5A)
 0.90A 1uakA-1dl5A:
undetectable		 1uakA-1dl5A:
18.29
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.
1e43 ALPHA-AMYLASE

(Bacillus
amyloliquefaciens) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 SER A 296
GLN A 293
GLY A 299
GLY A 301
GLY A 300
 None
None
None
CA  A 504 ( 4.3A)
CA  A 504 (-4.1A)
 0.91A 1uakA-1e43A:
undetectable		 1uakA-1e43A:
19.42
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.
1e6v METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT

(Methanopyrus
kandleri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 LEU B  58
ILE B 143
VAL B  80
LEU B  51
GLY B  53
 None
 0.92A 1uakA-1e6vB:
undetectable		 1uakA-1e6vB:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e6y METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT

(Methanosarcina
barkeri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		6 LEU B2054
GLY B2052
ILE B2139
VAL B2076
LEU B2047
GLY B2049
 None
 1.25A 1uakA-1e6yB:
undetectable		 1uakA-1e6yB:
20.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1p9p TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Escherichia
coli) 		PF01746
(tRNA_m1G_MT) 		12 LEU A  87
SER A  88
PRO A  89
GLN A  90
GLY A 113
SER A 132
ILE A 133
VAL A 137
LEU A 138
GLY A 140
GLY A 141
PRO A 144
 SAH  A 300 (-4.4A)
None
SAH  A 300 (-3.8A)
SAH  A 300 (-3.2A)
SAH  A 300 (-3.2A)
SAH  A 300 (-3.6A)
SAH  A 300 (-4.4A)
SAH  A 300 ( 4.0A)
SAH  A 300 (-4.1A)
SAH  A 300 (-3.1A)
SAH  A 300 (-3.5A)
SAH  A 300 (-4.5A)
 0.25A 1uakA-1p9pA:
30.4		 1uakA-1p9pA:
78.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1p9p TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Escherichia
coli) 		PF01746
(tRNA_m1G_MT) 		8 SER A  88
PRO A  89
GLN A  90
GLY A 113
ILE A 133
LEU A 138
GLY A 140
PRO A 144
 None
SAH  A 300 (-3.8A)
SAH  A 300 (-3.2A)
SAH  A 300 (-3.2A)
SAH  A 300 (-4.4A)
SAH  A 300 (-4.1A)
SAH  A 300 (-3.1A)
SAH  A 300 (-4.5A)
 1.11A 1uakA-1p9pA:
30.4		 1uakA-1p9pA:
78.15
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.
1urh 3-MERCAPTOPYRUVATE
SULFURTRANSFERASE

(Escherichia
coli) 		PF00581
(Rhodanese) 		5 LEU A 122
GLY A  95
ILE A  46
VAL A  91
GLY A 121
 None
 0.82A 1uakA-1urhA:
undetectable		 1uakA-1urhA:
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.
1uwi BETA-GALACTOSIDASE

(Sulfolobus
solfataricus) 		PF00232
(Glyco_hydro_1) 		5 GLY A 343
VAL A 327
LEU A 337
GLY A 338
GLY A 339
 None
 0.92A 1uakA-1uwiA:
undetectable		 1uakA-1uwiA:
20.44
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.
1vcl HEMOLYTIC LECTIN
CEL-III

(Cucumaria
echinata) 		PF00652
(Ricin_B_lectin) 		5 LEU A 165
GLY A 262
VAL A 178
LEU A 179
GLY A 264
 None
None
MG  A1102 (-4.5A)
None
None
 0.91A 1uakA-1vclA:
undetectable		 1uakA-1vclA:
16.29
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.
1wuu GALACTOKINASE

(Homo sapiens) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		5 LEU A 139
SER A 140
LEU A 135
GLY A 136
GLY A 137
 None
ANP  A 395 ( 3.1A)
ANP  A 395 (-4.3A)
ANP  A 395 (-3.4A)
ANP  A 395 (-4.6A)
 0.91A 1uakA-1wuuA:
undetectable		 1uakA-1wuuA:
24.17
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.
1zy9 ALPHA-GALACTOSIDASE

(Thermotoga
maritima) 		PF02065
(Melibiase) 		6 LEU A 505
SER A 506
GLY A 503
VAL A 452
GLY A 483
GLY A 482
 None
 1.34A 1uakA-1zy9A:
undetectable		 1uakA-1zy9A:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b42 XYLANASE INHIBITOR-I

(Triticum
aestivum) 		PF14541
(TAXi_C)
PF14543
(TAXi_N) 		5 PRO A   6
GLY A 380
GLY A 172
GLY A 379
PRO A 169
 None
 0.92A 1uakA-2b42A:
undetectable		 1uakA-2b42A:
20.92
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.
2d0o DIOL
DEHYDRATASE-REACTIVA
TING FACTOR LARGE
SUBUNIT

(Klebsiella
oxytoca) 		PF08841
(DDR) 		6 LEU A 179
GLN A 157
GLY A 112
ILE A 148
LEU A 133
GLY A 160
 None
 1.43A 1uakA-2d0oA:
undetectable		 1uakA-2d0oA:
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.
2d4y FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 1

(Salmonella
enterica) 		no annotation 5 LEU A 279
GLY A 277
ILE A 161
GLY A 281
GLY A 280
 None
 0.86A 1uakA-2d4yA:
undetectable		 1uakA-2d4yA:
17.65
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.
2dpn GLYCEROL KINASE

(Thermus
thermophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		6 LEU A 450
SER A 451
PRO A 452
GLY A 448
GLY A 446
GLY A 444
 None
 1.00A 1uakA-2dpnA:
undetectable		 1uakA-2dpnA:
20.20
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.
2fge ZINC METALLOPROTEASE
(INSULINASE FAMILY)

(Arabidopsis
thaliana) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc) 		5 LEU A 843
ILE A 883
VAL A 849
GLY A 855
GLY A 856
 None
 0.84A 1uakA-2fgeA:
undetectable		 1uakA-2fgeA:
14.57
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.
2kl3 ALR3790 PROTEIN

(Nostoc sp. PCC
7120) 		PF00581
(Rhodanese) 		6 LEU A  94
GLY A  68
ILE A  37
LEU A  90
GLY A  92
GLY A  93
 None
 1.36A 1uakA-2kl3A:
undetectable		 1uakA-2kl3A:
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.
2kl3 ALR3790 PROTEIN

(Nostoc sp. PCC
7120) 		PF00581
(Rhodanese) 		6 LEU A  94
GLY A  68
ILE A  37
VAL A  64
LEU A  90
GLY A  93
 None
 1.11A 1uakA-2kl3A:
undetectable		 1uakA-2kl3A:
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.
2ppy ENOYL-COA HYDRATASE

(Geobacillus
kaustophilus) 		PF00378
(ECH_1) 		5 PRO A 138
GLY A  69
LEU A 117
GLY A 116
GLY A 115
 None
 0.88A 1uakA-2ppyA:
undetectable		 1uakA-2ppyA:
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.
2uz0 TRIBUTYRIN ESTERASE

(Streptococcus
pneumoniae) 		PF00756
(Esterase) 		5 GLY A 144
ILE A 116
LEU A  42
GLY A 122
GLY A 123
 None
 0.93A 1uakA-2uz0A:
undetectable		 1uakA-2uz0A:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v4y URIDYLATE KINASE

(Escherichia
coli) 		PF00696
(AA_kinase) 		5 SER A 135
SER A 106
ILE A 108
LEU A  82
GLY A  80
 None
 0.93A 1uakA-2v4yA:
undetectable		 1uakA-2v4yA:
21.53
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.
2vgi PYRUVATE KINASE
ISOZYMES R/L

(Homo sapiens) 		PF00224
(PK)
PF02887
(PK_C) 		5 LEU A 546
GLY A 549
ILE A 472
VAL A 570
LEU A 571
 None
 0.91A 1uakA-2vgiA:
undetectable		 1uakA-2vgiA:
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.
2z1q ACYL-COA
DEHYDROGENASE

(Thermus
thermophilus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 LEU A 505
ILE A 575
LEU A 502
GLY A 503
GLY A 504
 None
 0.88A 1uakA-2z1qA:
undetectable		 1uakA-2z1qA:
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.
3abs ETHANOLAMINE
AMMONIA-LYASE LIGHT
CHAIN

(Escherichia
coli) 		PF05985
(EutC) 		5 PRO B 230
SER B 235
VAL B 106
GLY B 168
GLY B 227
 None
 0.89A 1uakA-3absB:
undetectable		 1uakA-3absB:
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.
3bwq CAPSID PROTEIN VP1

(Macaca mulatta
polyomavirus 1) 		PF00718
(Polyoma_coat) 		5 LEU A 290
ILE A 288
VAL A 243
LEU A 244
GLY A 251
 None
 0.91A 1uakA-3bwqA:
undetectable		 1uakA-3bwqA:
21.17
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.
3eg4 2,3,4,5-TETRAHYDROPY
RIDINE-2,6-DICARBOXY
LATE
N-SUCCINYLTRANSFERAS
E

(Brucella suis) 		PF00132
(Hexapep)
PF14602
(Hexapep_2)
PF14805
(THDPS_N_2) 		5 LEU A 165
ILE A 185
VAL A 208
LEU A 209
GLY A 192
 None
 0.91A 1uakA-3eg4A:
undetectable		 1uakA-3eg4A:
24.70
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.
3eno PUTATIVE
O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE

(Thermoplasma
acidophilum) 		PF00814
(Peptidase_M22) 		5 LEU A   6
GLY A 287
ILE A  94
VAL A   3
GLY A  16
 None
 0.87A 1uakA-3enoA:
undetectable		 1uakA-3enoA:
23.58
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.
3hi0 PUTATIVE
EXOPOLYPHOSPHATASE

(Agrobacterium
fabrum) 		PF02541
(Ppx-GppA) 		5 LEU A 151
PRO A 168
GLY A 147
LEU A 174
GLY A 171
 None
 0.88A 1uakA-3hi0A:
undetectable		 1uakA-3hi0A:
22.86
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.
3hix ALR3790 PROTEIN

(Nostoc sp. PCC
7120) 		PF00581
(Rhodanese) 		5 LEU A 109
ILE A  52
VAL A  79
LEU A 105
GLY A 108
 None
 0.79A 1uakA-3hixA:
undetectable		 1uakA-3hixA:
19.64
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.
3i99 UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Vibrio cholerae) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		5 LEU A  58
GLY A  74
ILE A  60
VAL A  35
LEU A  34
 FAD  A 358 ( 4.9A)
None
FAD  A 358 (-4.0A)
None
None
 0.81A 1uakA-3i99A:
undetectable		 1uakA-3i99A:
19.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ief TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Bartonella
henselae) 		PF01746
(tRNA_m1G_MT) 		8 SER A  86
PRO A  87
GLY A 111
SER A 130
ILE A 131
LEU A 136
GLY A 138
GLY A 139
 None
 0.63A 1uakA-3iefA:
21.1		 1uakA-3iefA:
42.35
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.
3ii7 KELCH-LIKE PROTEIN 7

(Homo sapiens) 		PF01344
(Kelch_1) 		5 SER A 422
GLY A 424
VAL A 447
LEU A 448
GLY A 436
 None
None
EDO  A 961 (-3.9A)
None
None
 0.92A 1uakA-3ii7A:
undetectable		 1uakA-3ii7A:
21.56
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.
3jtx AMINOTRANSFERASE

(Neisseria
meningitidis) 		PF00155
(Aminotran_1_2) 		6 GLY A 370
SER A 180
LEU A 358
GLY A 355
GLY A 368
PRO A 127
 None
 1.39A 1uakA-3jtxA:
undetectable		 1uakA-3jtxA:
22.17
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.
3jux PROTEIN TRANSLOCASE
SUBUNIT SECA

(Thermotoga
maritima) 		PF00271
(Helicase_C)
PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		6 LEU A 550
GLY A 578
LEU A 547
GLY A 548
GLY A 549
PRO A 476
 None
 1.36A 1uakA-3juxA:
undetectable		 1uakA-3juxA:
16.44
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.
3jwe MGLL PROTEIN

(Homo sapiens) 		PF12146
(Hydrolase_4) 		6 GLN A 245
GLY A 130
VAL A 159
LEU A 158
GLY A 135
GLY A 134
 None
None
None
F4P  A 314 (-4.8A)
None
None
 1.46A 1uakA-3jweA:
2.2		 1uakA-3jweA:
24.43
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.
3jwe MGLL PROTEIN

(Homo sapiens) 		PF12146
(Hydrolase_4) 		6 SER A 156
GLN A 245
GLY A 130
VAL A 159
LEU A 158
GLY A 135
 None
None
None
None
F4P  A 314 (-4.8A)
None
 1.50A 1uakA-3jweA:
2.2		 1uakA-3jweA:
24.43
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.
3k0s DNA MISMATCH REPAIR
PROTEIN MUTS

(Escherichia
coli) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 LEU A 603
SER A 604
PRO A 605
GLN A 606
GLY A 648
 None
 0.85A 1uakA-3k0sA:
undetectable		 1uakA-3k0sA:
15.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3knu TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Anaplasma
phagocytophilum) 		PF01746
(tRNA_m1G_MT) 		9 SER A  87
PRO A  88
GLY A 112
SER A 131
ILE A 132
VAL A 136
LEU A 137
GLY A 139
GLY A 140
 None
 0.40A 1uakA-3knuA:
23.8		 1uakA-3knuA:
40.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ky7 TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Staphylococcus
aureus) 		PF01746
(tRNA_m1G_MT) 		7 PRO A  87
GLY A 111
SER A 130
LEU A 136
GLY A 138
GLY A 139
PRO A 142
 OCS  A  86 ( 2.5A)
None
OCS  A  86 ( 3.8A)
None
None
None
None
 0.66A 1uakA-3ky7A:
19.8		 1uakA-3ky7A:
43.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ky7 TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Staphylococcus
aureus) 		PF01746
(tRNA_m1G_MT) 		7 PRO A  87
SER A 130
VAL A 135
LEU A 136
GLY A 138
GLY A 139
PRO A 142
 OCS  A  86 ( 2.5A)
OCS  A  86 ( 3.8A)
None
None
None
None
None
 0.70A 1uakA-3ky7A:
19.8		 1uakA-3ky7A:
43.06
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.
3llt SERINE/THREONINE
KINASE-1, PFLAMMER

(Plasmodium
falciparum) 		PF00069
(Pkinase) 		5 LEU A 678
PRO A 680
ILE A 661
LEU A 764
GLY A 761
 None
 0.88A 1uakA-3lltA:
undetectable		 1uakA-3lltA:
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.
3nwy URIDYLATE KINASE

(Mycobacterium
tuberculosis) 		PF00696
(AA_kinase) 		6 GLY A  78
SER A 108
VAL A  74
LEU A  37
GLY A  38
GLY A  39
 None
 1.18A 1uakA-3nwyA:
undetectable		 1uakA-3nwyA:
27.69
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.
3qoy 50S RIBOSOMAL
PROTEIN L1

(Aquifex
aeolicus) 		PF00687
(Ribosomal_L1) 		6 LEU A 140
PRO A 142
GLY A 136
VAL A 128
LEU A 131
GLY A 132
 None
 1.48A 1uakA-3qoyA:
undetectable		 1uakA-3qoyA:
23.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3quv TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Mycobacteroides
abscessus) 		PF01746
(tRNA_m1G_MT) 		8 PRO A  85
GLY A 109
SER A 132
ILE A 133
VAL A 137
LEU A 138
GLY A 140
GLY A 141
 EDO  A 243 (-3.7A)
EDO  A 244 ( 4.1A)
None
None
None
EDO  A 243 (-4.0A)
EDO  A 243 (-4.1A)
EDO  A 243 (-3.6A)
 0.77A 1uakA-3quvA:
20.7		 1uakA-3quvA:
40.00
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.
3qz4 ENDO-1,4-BETA-XYLANA
SE D

(Bacteroides
thetaiotaomicron) 		PF04616
(Glyco_hydro_43) 		6 SER A 154
PRO A 155
GLY A 182
SER A 153
ILE A 151
GLY A 180
 None
EDO  A 339 (-3.6A)
None
EDO  A 339 (-4.2A)
EDO  A 339 ( 4.7A)
None
 1.32A 1uakA-3qz4A:
undetectable		 1uakA-3qz4A:
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.
3s2u UDP-N-ACETYLGLUCOSAM
INE--N-ACETYLMURAMYL
-(PENTAPEPTIDE)
PYROPHOSPHORYL-UNDEC
APRENOL
N-ACETYLGLUCOSAMINE
TRANSFERASE

(Pseudomonas
aeruginosa) 		PF03033
(Glyco_transf_28)
PF04101
(Glyco_tran_28_C) 		5 LEU A  99
GLY A  10
ILE A 120
GLY A 101
GLY A 100
 None
 0.86A 1uakA-3s2uA:
undetectable		 1uakA-3s2uA:
26.05
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.
3tbh O-ACETYL SERINE
SULFHYDRYLASE

(Leishmania
donovani) 		PF00291
(PALP) 		5 GLY A  95
SER A  14
ILE A  15
LEU A  90
GLY A  91
 None
 0.84A 1uakA-3tbhA:
undetectable		 1uakA-3tbhA:
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.
3vis ESTERASE

(Thermobifida
alba) 		PF12740
(Chlorophyllase2) 		6 GLY A 171
SER A 224
ILE A 209
GLY A 167
GLY A 172
PRO A 190
 None
 1.39A 1uakA-3visA:
undetectable		 1uakA-3visA:
23.94
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.
3zh2 L-LACTATE
DEHYDROGENASE

(Plasmodium
falciparum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A  13
ILE A 243
VAL A 237
GLY A  17
GLY A  16
 None
 0.91A 1uakA-3zh2A:
undetectable		 1uakA-3zh2A:
22.16
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.
3zh2 L-LACTATE
DEHYDROGENASE

(Plasmodium
falciparum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 SER A  64
SER A  62
VAL A   8
LEU A   9
GLY A  11
 None
 0.79A 1uakA-3zh2A:
undetectable		 1uakA-3zh2A:
22.16
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.
4a69 HISTONE DEACETYLASE
3,

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		6 GLY A 257
ILE A 150
VAL A 292
LEU A 293
GLY A 294
GLY A 295
 None
 1.28A 1uakA-4a69A:
undetectable		 1uakA-4a69A:
20.72
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.
4a69 HISTONE DEACETYLASE
3,

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		6 GLY A 296
ILE A 150
VAL A 292
LEU A 293
GLY A 294
GLY A 295
 ACT  A 501 (-3.0A)
None
None
None
None
None
 1.46A 1uakA-4a69A:
undetectable		 1uakA-4a69A:
20.72
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.
4bz7 HISTONE DEACETYLASE
8

(Schistosoma
mansoni) 		PF00850
(Hist_deacetyl) 		6 GLY A 339
ILE A 157
VAL A 280
LEU A 336
GLY A 337
GLY A 338
 B3N  A 700 ( 4.1A)
None
None
None
None
None
 1.24A 1uakA-4bz7A:
undetectable		 1uakA-4bz7A:
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.
4cak INTEGRIN ALPHA-IIB

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 SER A 220
VAL A 182
LEU A 183
GLY A 148
PRO A 145
 None
 0.88A 1uakA-4cakA:
undetectable		 1uakA-4cakA:
16.05
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.
4cng SPOU RRNA METHYLASE

(Sulfolobus
acidocaldarius) 		PF00588
(SpoU_methylase) 		5 SER A  78
GLY A 111
ILE A 131
VAL A 139
LEU A 140
 SAH  A1158 ( 2.6A)
SAH  A1157 (-3.1A)
SAH  A1157 (-3.6A)
SAH  A1157 ( 4.3A)
SAH  A1157 (-3.8A)
 0.84A 1uakA-4cngA:
7.3		 1uakA-4cngA:
29.25
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.
4fe1 PHOTOSYSTEM I
REACTION CENTER
SUBUNIT XI

(Thermosynechococcus
elongatus) 		PF02605
(PsaL) 		5 LEU L  41
SER L  42
PRO L  43
GLN L 119
GLY L  40
 None
 0.93A 1uakA-4fe1L:
undetectable		 1uakA-4fe1L:
19.17
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.
4fff LEVAN
FRUCTOTRANSFERASE

(Paenarthrobacter
ureafaciens) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		5 GLY A 392
SER A 412
ILE A 411
VAL A 387
LEU A 388
 None
 0.80A 1uakA-4fffA:
undetectable		 1uakA-4fffA:
21.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4h3z TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Paraburkholderia
phymatum) 		PF01746
(tRNA_m1G_MT) 		6 PRO A  93
GLY A 117
VAL A 141
LEU A 142
GLY A 145
PRO A 148
 SAH  A 301 (-3.7A)
SAH  A 301 (-3.5A)
SAH  A 301 (-3.9A)
SAH  A 301 (-4.3A)
SAH  A 301 (-3.5A)
SAH  A 301 (-4.4A)
 1.25A 1uakA-4h3zA:
27.4		 1uakA-4h3zA:
52.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4h3z TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Paraburkholderia
phymatum) 		PF01746
(tRNA_m1G_MT) 		9 SER A  92
PRO A  93
GLY A 117
SER A 136
VAL A 141
LEU A 142
GLY A 144
GLY A 145
PRO A 148
 None
SAH  A 301 (-3.7A)
SAH  A 301 (-3.5A)
SAH  A 301 (-3.4A)
SAH  A 301 (-3.9A)
SAH  A 301 (-4.3A)
SAH  A 301 (-3.1A)
SAH  A 301 (-3.5A)
SAH  A 301 (-4.4A)
 0.24A 1uakA-4h3zA:
27.4		 1uakA-4h3zA:
52.30
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.
4hpf POTASSIUM CHANNEL
SUBFAMILY U MEMBER 1

(Homo sapiens) 		PF03493
(BK_channel_a) 		5 GLY A 491
SER A 795
ILE A 716
LEU A 488
GLY A 486
 None
 0.88A 1uakA-4hpfA:
undetectable		 1uakA-4hpfA:
16.02
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.
4i3f SERINE HYDROLASE
CCSP0084

(Cycloclasticus
sp. P1) 		PF12697
(Abhydrolase_6) 		5 LEU A 126
ILE A 100
LEU A  29
GLY A 106
GLY A 107
 None
 0.91A 1uakA-4i3fA:
undetectable		 1uakA-4i3fA:
26.90
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.
4izd ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Ruegeria
pomeroyi) 		PF00378
(ECH_1) 		6 LEU A  71
GLY A 117
ILE A  40
LEU A 122
GLY A 119
GLY A 118
 None
 1.41A 1uakA-4izdA:
undetectable		 1uakA-4izdA:
25.32
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.
4jbh ALCOHOL
DEHYDROGENASE (ZINC)

(Pyrobaculum
aerophilum) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 245
VAL A 275
LEU A 274
GLY A 248
GLY A 247
 None
 0.85A 1uakA-4jbhA:
undetectable		 1uakA-4jbhA:
27.06
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.
4kjy HIGH-AFFINITY SIRPA
VARIANT FD6

(Homo sapiens) 		PF07686
(V-set) 		5 GLN B   8
GLY B  41
ILE B  78
LEU B 111
GLY B  87
 None
 0.89A 1uakA-4kjyB:
undetectable		 1uakA-4kjyB:
20.88
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.
4km3 METHIONINE
AMINOPEPTIDASE

(Streptococcus
pneumoniae) 		PF00557
(Peptidase_M24) 		6 GLN A 266
GLY A 132
VAL A 100
LEU A 101
GLY A 102
GLY A 103
 None
 1.30A 1uakA-4km3A:
undetectable		 1uakA-4km3A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lry PTS-DEPENDENT
DIHYDROXYACETONE
KINASE,
DIHYDROXYACETONE-BIN
DING SUBUNIT DHAK

(Escherichia
coli) 		PF02733
(Dak1) 		6 LEU A  48
GLY A  67
SER A  50
ILE A 102
VAL A 154
GLY A 161
 None
 1.16A 1uakA-4lryA:
undetectable		 1uakA-4lryA:
21.33
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.
4mj0 VP1 CAPSID PROTEIN

(Human
polyomavirus 1) 		PF00718
(Polyoma_coat) 		5 LEU A 290
ILE A 288
VAL A 243
LEU A 244
GLY A 251
 None
 0.92A 1uakA-4mj0A:
undetectable		 1uakA-4mj0A:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ofx CYSTATHIONINE
BETA-SYNTHASE

(Coxiella
burnetii) 		PF00291
(PALP) 		6 LEU A  80
GLN A 146
ILE A  10
VAL A  42
GLY A  40
GLY A  39
 None
 1.12A 1uakA-4ofxA:
undetectable		 1uakA-4ofxA:
22.99
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.
4p9n CARBOXYLESTERASE

(Sulfolobus
shibatae) 		PF07859
(Abhydrolase_3) 		5 LEU A 175
ILE A 147
LEU A  77
GLY A 153
GLY A 154
 None
 0.82A 1uakA-4p9nA:
undetectable		 1uakA-4p9nA:
23.29
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.
4pe8 TAT-LINKED QUALITY
CONTROL PROTEIN TATD

(Escherichia
coli) 		PF01026
(TatD_DNase) 		5 PRO A  63
GLY A  36
SER A  66
GLY A  90
GLY A  60
 None
 0.84A 1uakA-4pe8A:
undetectable		 1uakA-4pe8A:
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.
4phc HISTIDINE--TRNA
LIGASE, CYTOPLASMIC

(Homo sapiens) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		5 LEU A 382
SER A 383
GLN A 173
GLY A 361
GLY A 381
 None
HIS  A1001 (-4.5A)
HIS  A1001 (-3.0A)
None
HIS  A1001 (-3.7A)
 0.90A 1uakA-4phcA:
undetectable		 1uakA-4phcA:
21.56
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.
4r72 ABC-TYPE FE3+
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Actinobacillus
pleuropneumoniae) 		PF13343
(SBP_bac_6) 		5 GLY A  58
SER A  65
LEU A 230
GLY A 231
GLY A 232
 None
 0.89A 1uakA-4r72A:
undetectable		 1uakA-4r72A:
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.
4uhh ESTERASE

(Thermogutta
terrifontis) 		PF00561
(Abhydrolase_1) 		6 LEU A 100
GLY A 103
VAL A  57
LEU A  31
GLY A  98
GLY A  99
 None
 1.43A 1uakA-4uhhA:
undetectable		 1uakA-4uhhA:
24.38
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.
4wqo VON HIPPEL-LINDAU
DISEASE TUMOR
SUPPRESSOR

(Homo sapiens) 		PF01847
(VHL)
PF17211
(VHL_C) 		6 PRO A 103
SER A  80
ILE A 151
VAL A  83
LEU A 101
GLY A 106
 None
 1.48A 1uakA-4wqoA:
undetectable		 1uakA-4wqoA:
27.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ypw TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Haemophilus
influenzae) 		PF01746
(tRNA_m1G_MT) 		12 LEU A  87
SER A  88
PRO A  89
GLN A  90
GLY A 113
SER A 132
ILE A 133
VAL A 137
LEU A 138
GLY A 140
GLY A 141
PRO A 144
 None
None
4FD  A 301 ( 3.6A)
None
4FD  A 301 (-4.7A)
4FD  A 301 (-3.2A)
4FD  A 301 (-4.1A)
4FD  A 301 ( 4.4A)
4FD  A 301 (-3.9A)
4FD  A 301 (-3.6A)
4FD  A 301 (-3.9A)
4FD  A 301 (-4.5A)
 0.36A 1uakA-4ypwA:
31.4		 1uakA-4ypwA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ypw TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Haemophilus
influenzae) 		PF01746
(tRNA_m1G_MT) 		6 PRO A  89
GLN A  90
GLY A 113
LEU A 138
GLY A 141
PRO A 144
 4FD  A 301 ( 3.6A)
None
4FD  A 301 (-4.7A)
4FD  A 301 (-3.9A)
4FD  A 301 (-3.9A)
4FD  A 301 (-4.5A)
 1.21A 1uakA-4ypwA:
31.4		 1uakA-4ypwA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ypw TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Haemophilus
influenzae) 		PF01746
(tRNA_m1G_MT) 		6 SER A  88
PRO A  89
GLN A  90
GLY A 113
LEU A 138
GLY A 140
 None
4FD  A 301 ( 3.6A)
None
4FD  A 301 (-4.7A)
4FD  A 301 (-3.9A)
4FD  A 301 (-3.6A)
 1.26A 1uakA-4ypwA:
31.4		 1uakA-4ypwA:
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.
4ziu UNCHARACTERIZED
LIPOPROTEIN YFHM

(Escherichia
coli) 		PF07678
(A2M_comp) 		5 SER A1385
GLN A1416
SER A1384
LEU A1341
GLY A1340
 None
 0.87A 1uakA-4ziuA:
undetectable		 1uakA-4ziuA:
17.70
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
GAMMA

(Methanothermobacter
marburgensis) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 LEU B  57
ILE B 142
VAL B  79
LEU B  50
GLY B  52
 None
 0.92A 1uakA-5a8rB:
undetectable		 1uakA-5a8rB:
19.16
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.
5bq9 UNCHARACTERIZED
PROTEIN

(Legionella
pneumophila) 		PF12252
(SidE) 		5 LEU A  16
GLY A  67
ILE A  18
VAL A  47
LEU A  46
 None
 0.89A 1uakA-5bq9A:
undetectable		 1uakA-5bq9A:
17.30
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.
5btx LPG1496

(Legionella
pneumophila) 		no annotation 5 LEU A  16
GLY A  67
ILE A  18
VAL A  47
LEU A  46
 None
 0.89A 1uakA-5btxA:
undetectable		 1uakA-5btxA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cbm M17 FAMILY
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF00883
(Peptidase_M17) 		5 SER A 391
ILE A 393
LEU A 385
GLY A 382
GLY A 381
 SO4  A 709 (-3.9A)
None
None
None
ZN  A 703 ( 4.8A)
 0.90A 1uakA-5cbmA:
2.6		 1uakA-5cbmA:
19.00
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.
5e6s INTEGRIN ALPHA-L

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		6 LEU A 536
SER A 537
PRO A 538
ILE A 471
GLY A 534
GLY A 535
 None
 1.20A 1uakA-5e6sA:
3.7		 1uakA-5e6sA:
17.82
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.
5fai RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE
NEP1

(Homo sapiens) 		PF03587
(EMG1) 		5 SER A 177
GLY A 201
SER A 218
ILE A 219
LEU A 224
 CIT  A 302 ( 2.7A)
SAH  A 301 (-3.2A)
SAH  A 301 (-3.5A)
SAH  A 301 (-4.3A)
SAH  A 301 (-4.0A)
 0.62A 1uakA-5faiA:
5.0		 1uakA-5faiA:
23.47
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.
5ffq SHUY-LIKE PROTEIN

(Escherichia
coli) 		PF13460
(NAD_binding_10) 		5 GLY A 172
LEU A 153
GLY A 152
GLY A 151
PRO A 150
 None
PO4  A 301 (-4.8A)
None
None
None
 0.91A 1uakA-5ffqA:
undetectable		 1uakA-5ffqA:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fv4 CARBOXYLIC ESTER
HYDROLASE

(Sus scrofa) 		PF00135
(COesterase) 		6 PRO A 107
GLY A 114
ILE A 104
VAL A 146
GLY A 193
GLY A 192
 None
 1.18A 1uakA-5fv4A:
undetectable		 1uakA-5fv4A:
20.23
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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		6 GLY A  69
ILE A 529
LEU A  22
GLY A  25
GLY A  24
PRO A  23
 None
 1.46A 1uakA-5h42A:
undetectable		 1uakA-5h42A:
14.69
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.
5vqd BETA-GLUCOSIDE
PHOSPHORYLASE BGLX

(unidentified) 		no annotation 5 LEU A 405
SER A 406
PRO A 407
GLN A 408
GLY A 546
 None
 0.93A 1uakA-5vqdA:
undetectable		 1uakA-5vqdA:
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.
5vqd BETA-GLUCOSIDE
PHOSPHORYLASE BGLX

(unidentified) 		no annotation 5 LEU A 405
SER A 406
PRO A 407
GLN A 408
ILE A 413
 None
 0.74A 1uakA-5vqdA:
undetectable		 1uakA-5vqdA:
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.
5wax -

(-) 		no annotation 5 GLN A 115
GLY A 142
ILE A  70
LEU A 139
GLY A  91
 None
GOL  A 502 ( 4.4A)
None
None
None
 0.93A 1uakA-5waxA:
undetectable		 1uakA-5waxA:
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 35O22 FAB LIGHT
CHAIN

(Homo sapiens) 		no annotation 6 GLY I 101
SER I  34
ILE I  33
VAL I  97
LEU I   4
GLY I  99
 None
 1.36A 1uakA-5wduI:
undetectable		 1uakA-5wduI:
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.
5wgc DAUNORUBICIN-DOXORUB
ICIN POLYKETIDE
SYNTHASE

(Streptomyces
peucetius) 		no annotation 6 LEU A  86
SER A  85
GLY A 120
LEU A 298
GLY A 301
GLY A 300
 42Y  A 118 ( 4.7A)
None
42Y  A 118 ( 4.9A)
None
None
42Y  A 118 ( 3.2A)
 1.29A 1uakA-5wgcA:
undetectable		 1uakA-5wgcA:
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.
5wgc DAUNORUBICIN-DOXORUB
ICIN POLYKETIDE
SYNTHASE

(Streptomyces
peucetius) 		no annotation 6 SER A  85
GLN A  89
GLY A 120
LEU A 298
GLY A 301
GLY A 300
 None
None
42Y  A 118 ( 4.9A)
None
None
42Y  A 118 ( 3.2A)
 1.34A 1uakA-5wgcA:
undetectable		 1uakA-5wgcA:
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.
5wgc DAUNORUBICIN-DOXORUB
ICIN POLYKETIDE
SYNTHASE

(Streptomyces
peucetius) 		no annotation 6 SER A  85
GLN A  89
GLY A 121
LEU A 298
GLY A 301
GLY A 300
 None
None
None
None
None
42Y  A 118 ( 3.2A)
 1.23A 1uakA-5wgcA:
undetectable		 1uakA-5wgcA:
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.
5wyr TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Pseudomonas
aeruginosa) 		no annotation 12 LEU A  92
SER A  93
PRO A  94
GLN A  95
GLY A 118
SER A 137
ILE A 138
VAL A 142
LEU A 143
GLY A 145
GLY A 146
PRO A 149
 SFG  A 400 (-4.6A)
None
SFG  A 400 (-3.7A)
SFG  A 400 (-2.7A)
SFG  A 400 (-3.4A)
SFG  A 400 (-3.3A)
SFG  A 400 (-4.4A)
SFG  A 400 ( 4.1A)
SFG  A 400 (-4.2A)
SFG  A 400 (-3.2A)
SFG  A 400 (-3.7A)
SFG  A 400 (-4.4A)
 0.29A 1uakA-5wyrA:
29.7		 1uakA-5wyrA:
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.
5wyr TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Pseudomonas
aeruginosa) 		no annotation 6 PRO A  94
GLN A  95
GLY A 118
LEU A 143
GLY A 146
PRO A 149
 SFG  A 400 (-3.7A)
SFG  A 400 (-2.7A)
SFG  A 400 (-3.4A)
SFG  A 400 (-4.2A)
SFG  A 400 (-3.7A)
SFG  A 400 (-4.4A)
 1.28A 1uakA-5wyrA:
29.7		 1uakA-5wyrA:
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.
5wyr TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Pseudomonas
aeruginosa) 		no annotation 6 SER A  93
PRO A  94
GLN A  95
GLY A 118
LEU A 143
GLY A 145
 None
SFG  A 400 (-3.7A)
SFG  A 400 (-2.7A)
SFG  A 400 (-3.4A)
SFG  A 400 (-4.2A)
SFG  A 400 (-3.2A)
 1.22A 1uakA-5wyrA:
29.7		 1uakA-5wyrA:
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.
5y4d ANKYRIN-1,ANKYRIN-2,
ANKYRIN-2

(Homo sapiens;
Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4) 		5 LEU A2333
SER A2334
PRO A2335
LEU A2300
GLY A2299
 None
 0.89A 1uakA-5y4dA:
undetectable		 1uakA-5y4dA:
17.74