SIMILAR PATTERNS OF AMINO ACIDS FOR 3KVR_A_URFA2001_1

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.
1cjy PROTEIN (CYTOSOLIC
PHOSPHOLIPASE A2)

(Homo sapiens) 		PF00168
(C2)
PF01735
(PLA2_B) 		5 THR A 701
PHE A 205
LEU A 212
LEU A 218
ILE A 192
 None
 1.35A 3kvrA-1cjyA:
undetectable		 3kvrA-1cjyA:
16.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cvm PHYTASE

(Bacillus
amyloliquefaciens) 		PF02333
(Phytase) 		5 THR A 177
PHE A 204
GLU A 184
LEU A 222
ILE A 224
 None
 1.27A 3kvrA-1cvmA:
undetectable		 3kvrA-1cvmA:
22.67
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.
1d5y ROB TRANSCRIPTION
FACTOR

(Escherichia
coli) 		PF06445
(GyrI-like)
PF12833
(HTH_18) 		5 THR A 136
GLY A 221
GLU A 134
LEU A 219
ILE A 261
 None
 1.05A 3kvrA-1d5yA:
undetectable		 3kvrA-1d5yA:
22.82
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.
1ezv UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
CORE PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16) 		5 THR B  77
GLY B  75
GLU B  72
LEU B  94
ILE B  28
 None
 0.98A 3kvrA-1ezvB:
undetectable		 3kvrA-1ezvB:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fs2 SKP2

(Homo sapiens) 		PF12937
(F-box-like) 		5 GLY A 369
GLU A 367
LEU A 377
LEU A 398
ILE A 400
 None
 1.05A 3kvrA-1fs2A:
undetectable		 3kvrA-1fs2A:
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.
1ioa ARCELIN-5A

(Phaseolus
vulgaris) 		PF00139
(Lectin_legB) 		5 THR A 205
GLY A 207
PHE A 127
GLU A 214
LEU A 208
 None
 1.31A 3kvrA-1ioaA:
undetectable		 3kvrA-1ioaA:
21.78
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.
1j2r HYPOTHETICAL
ISOCHORISMATASE
FAMILY PROTEIN YECD

(Escherichia
coli) 		PF00857
(Isochorismatase) 		5 PHE A 118
GLU A 155
LEU A 160
LEU A 137
ILE A 135
 None
 1.34A 3kvrA-1j2rA:
undetectable		 3kvrA-1j2rA:
20.86
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.
1jdz 5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE

(Sulfolobus
solfataricus) 		PF01048
(PNP_UDP_1) 		5 THR A  89
GLY A  91
PHE A 160
GLU A 180
MET A 181
 SO4  A 250 ( 3.0A)
FMB  A 270 (-3.3A)
None
FMB  A 270 (-4.6A)
FMB  A 270 (-3.8A)
 0.62A 3kvrA-1jdzA:
24.5		 3kvrA-1jdzA:
24.68
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.
1lcy HTRA2 SERINE
PROTEASE

(Homo sapiens) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 GLY A 273
ARG A 310
LEU A 274
LEU A 317
ILE A 308
 None
 1.20A 3kvrA-1lcyA:
undetectable		 3kvrA-1lcyA:
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.
1lpb LIPASE

(Homo sapiens) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 GLY B   9
ARG B 164
GLU B   2
LEU B   8
ILE B 123
 None
 1.31A 3kvrA-1lpbB:
undetectable		 3kvrA-1lpbB:
21.86
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 THR A 158
GLY A 144
PHE A 147
LEU A 160
LEU A 166
 None
 1.30A 3kvrA-1nneA:
undetectable		 3kvrA-1nneA:
16.97
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.
1ocm MALONAMIDASE E2

(Bradyrhizobium
japonicum) 		PF01425
(Amidase) 		5 GLY A 203
PHE A 213
LEU A 200
LEU A 192
ILE A 168
 None
 1.26A 3kvrA-1ocmA:
undetectable		 3kvrA-1ocmA:
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.
1odi PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermus
thermophilus) 		PF01048
(PNP_UDP_1) 		5 THR A  90
GLY A  92
PHE A 159
GLU A 179
MET A 180
 SO4  A1236 ( 3.0A)
ADN  A1237 (-3.4A)
ADN  A1237 (-4.3A)
ADN  A1237 (-4.9A)
ADN  A1237 (-3.7A)
 0.41A 3kvrA-1odiA:
25.4		 3kvrA-1odiA:
25.96
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.
1vhi EPSTEIN BARR VIRUS
NUCLEAR ANTIGEN-1

(Human
gammaherpesvirus
4) 		PF02905
(EBV-NA1) 		5 THR A 524
PHE A 571
GLN A 530
ARG A 496
LEU A 485
 None
 1.16A 3kvrA-1vhiA:
undetectable		 3kvrA-1vhiA:
18.89
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.
1vkh PUTATIVE SERINE
HYDROLASE

(Saccharomyces
cerevisiae) 		PF07859
(Abhydrolase_3) 		5 THR A  93
GLY A 139
LEU A 140
LEU A 141
ILE A 119
 None
 1.33A 3kvrA-1vkhA:
4.5		 3kvrA-1vkhA:
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.
1yix DEOXYRIBONUCLEASE
YCFH

(Escherichia
coli) 		PF01026
(TatD_DNase) 		5 GLY A 165
GLU A 162
LEU A 167
LEU A 168
ILE A 174
 None
 0.83A 3kvrA-1yixA:
undetectable		 3kvrA-1yixA:
24.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yix DEOXYRIBONUCLEASE
YCFH

(Escherichia
coli) 		PF01026
(TatD_DNase) 		5 THR A 163
GLY A 165
LEU A 167
LEU A 168
ILE A 174
 None
 1.17A 3kvrA-1yixA:
undetectable		 3kvrA-1yixA:
24.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z34 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Trichomonas
vaginalis) 		PF01048
(PNP_UDP_1) 		5 THR A  90
GLY A  92
PHE A 159
GLU A 179
MET A 180
 2FD  A 300 (-4.2A)
2FD  A 300 (-3.1A)
2FD  A 300 (-4.4A)
None
2FD  A 300 (-3.7A)
 0.60A 3kvrA-1z34A:
24.1		 3kvrA-1z34A:
26.35
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.
2ccq PEPTIDE N-GLYCANASE
HOMOLOG

(Homo sapiens) 		PF09409
(PUB) 		5 PHE A  28
GLU A  30
LEU A  35
LEU A  36
ILE A 105
 GOL  A1110 ( 3.5A)
None
None
None
None
 0.96A 3kvrA-2ccqA:
undetectable		 3kvrA-2ccqA:
16.35
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.
2d4p HYPOTHETICAL PROTEIN
TTHA1254

(Thermus
thermophilus) 		PF09390
(DUF1999) 		5 GLY A  78
GLU A  74
LEU A  79
LEU A  80
ILE A  68
 None
 1.35A 3kvrA-2d4pA:
undetectable		 3kvrA-2d4pA:
19.74
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.
2fl3 R.HINP1I RESTRICTION
ENDONUCLEASE

(Haemophilus
influenzae) 		PF11463
(R-HINP1I) 		5 GLY A 211
PHE A 119
GLU A 140
LEU A 207
ILE A 213
 None
 1.23A 3kvrA-2fl3A:
undetectable		 3kvrA-2fl3A:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ft3 BIGLYCAN

(Bos taurus) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		5 GLY A 223
GLU A 197
LEU A 200
LEU A 224
ILE A 187
 None
 1.21A 3kvrA-2ft3A:
undetectable		 3kvrA-2ft3A:
23.12
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.
2ofk 3-METHYLADENINE DNA
GLYCOSYLASE I,
CONSTITUTIVE

(Salmonella
enterica) 		PF03352
(Adenine_glyco) 		5 ARG A  89
GLU A  74
LEU A  79
LEU A  80
ILE A  92
 None
 1.01A 3kvrA-2ofkA:
undetectable		 3kvrA-2ofkA:
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.
2oxf URIDINE
PHOSPHORYLASE

(Salmonella
enterica) 		PF01048
(PNP_UDP_1) 		6 GLY A1096
PHE A1162
GLN A1166
ARG A1168
GLU A1196
MET A1197
 None
 0.82A 3kvrA-2oxfA:
25.5		 3kvrA-2oxfA:
25.23
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.
2oxf URIDINE
PHOSPHORYLASE

(Salmonella
enterica) 		PF01048
(PNP_UDP_1) 		6 THR A1095
PHE A1162
GLN A1166
ARG A1168
GLU A1196
MET A1197
 None
 1.43A 3kvrA-2oxfA:
25.5		 3kvrA-2oxfA:
25.23
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.
2van DNA POLYMERSE BETA

(Rattus
norvegicus) 		PF10391
(DNA_pol_lambd_f)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		5 THR A 225
GLY A 237
PHE A 146
LEU A 228
ILE A 138
 None
 1.18A 3kvrA-2vanA:
undetectable		 3kvrA-2vanA:
24.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a0r SENSOR PROTEIN

(Thermotoga
maritima) 		PF00512
(HisKA)
PF00989
(PAS)
PF02518
(HATPase_c) 		5 GLY A 469
PHE A 465
GLU A 467
LEU A 430
ILE A 428
 None
 1.09A 3kvrA-3a0rA:
undetectable		 3kvrA-3a0rA:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a0r SENSOR PROTEIN

(Thermotoga
maritima) 		PF00512
(HisKA)
PF00989
(PAS)
PF02518
(HATPase_c) 		5 GLY A 469
PHE A 465
GLU A 467
LEU A 430
ILE A 514
 None
 1.34A 3kvrA-3a0rA:
undetectable		 3kvrA-3a0rA:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a7k HALORHODOPSIN

(Natronomonas
pharaonis) 		PF01036
(Bac_rhodopsin) 		5 THR A 207
GLY A 143
LEU A 141
LEU A 140
ILE A  67
 None
 1.20A 3kvrA-3a7kA:
undetectable		 3kvrA-3a7kA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bje NUCLEOSIDE
PHOSPHORYLASE,
PUTATIVE

(Trypanosoma
brucei) 		PF01048
(PNP_UDP_1) 		7 THR A 140
GLY A 142
PHE A 242
GLN A 246
ARG A 248
GLU A 284
MET A 285
 R1P  A 401 (-3.0A)
URA  A 501 (-3.4A)
URA  A 501 (-4.4A)
URA  A 501 (-3.0A)
URA  A 501 (-2.9A)
R1P  A 401 ( 4.6A)
R1P  A 401 ( 3.9A)
 0.29A 3kvrA-3bjeA:
23.9		 3kvrA-3bjeA:
24.09
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.
3bq7 DIACYLGLYCEROL
KINASE DELTA

(Homo sapiens) 		PF07647
(SAM_2) 		5 GLY A  33
GLU A   9
LEU A  36
LEU A  37
ILE A  62
 None
 1.26A 3kvrA-3bq7A:
undetectable		 3kvrA-3bq7A:
13.27
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.
3bs8 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Bacillus
subtilis) 		PF00202
(Aminotran_3) 		5 THR A 122
GLY A 149
GLU A 120
LEU A 152
LEU A 153
 PMP  A 431 ( 4.4A)
None
None
None
None
 1.16A 3kvrA-3bs8A:
undetectable		 3kvrA-3bs8A:
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.
3e9y ACETOLACTATE
SYNTHASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A 325
PHE A 320
GLU A 322
LEU A 435
ILE A 296
 None
 1.21A 3kvrA-3e9yA:
undetectable		 3kvrA-3e9yA:
18.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3euf URIDINE
PHOSPHORYLASE 1

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		5 THR A 141
GLY A 143
LEU A 272
LEU A 273
ILE A 281
 PO4  A 401 ( 3.0A)
BAU  A 400 (-3.3A)
BAU  A 400 ( 4.2A)
BAU  A 400 ( 4.3A)
BAU  A 400 (-4.7A)
 0.74A 3kvrA-3eufA:
46.5		 3kvrA-3eufA:
75.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3euf URIDINE
PHOSPHORYLASE 1

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		9 THR A 141
GLY A 143
PHE A 213
GLN A 217
ARG A 219
GLU A 248
MET A 249
LEU A 272
LEU A 273
 PO4  A 401 ( 3.0A)
BAU  A 400 (-3.3A)
BAU  A 400 (-4.4A)
BAU  A 400 (-3.1A)
BAU  A 400 (-3.0A)
None
BAU  A 400 (-3.8A)
BAU  A 400 ( 4.2A)
BAU  A 400 ( 4.3A)
 0.26A 3kvrA-3eufA:
46.5		 3kvrA-3eufA:
75.91
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.
3eul POSSIBLE
NITRATE/NITRITE
RESPONSE
TRANSCRIPTIONAL
REGULATORY PROTEIN
NARL (DNA-BINDING
RESPONSE REGULATOR,
LUXR FAMILY)

(Mycobacterium
tuberculosis) 		PF00072
(Response_reg) 		5 GLY A  14
PHE A  20
GLU A  39
LEU A  59
ILE A  88
 None
 1.24A 3kvrA-3eulA:
2.9		 3kvrA-3eulA:
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.
3h1l CYTOCHROME B

(Gallus gallus) 		PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B) 		5 GLY C  49
GLN C  45
LEU C  51
LEU C  52
ILE C  80
 HEM  C 501 (-3.3A)
HEM  C 501 (-4.5A)
None
HEM  C 501 (-4.0A)
None
 1.00A 3kvrA-3h1lC:
undetectable		 3kvrA-3h1lC:
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.
3hng VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 1

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 GLY A1155
GLU A1152
LEU A1157
LEU A1158
ILE A1000
 None
 1.25A 3kvrA-3hngA:
undetectable		 3kvrA-3hngA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kcc CATABOLITE GENE
ACTIVATOR

(Escherichia
coli) 		PF00027
(cNMP_binding)
PF00325
(Crp) 		5 THR A 182
GLY A 184
GLU A 181
LEU A 187
ILE A 143
 None
None
CMP  A 303 ( 4.4A)
None
None
 1.11A 3kvrA-3kccA:
undetectable		 3kvrA-3kccA:
23.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kvy URIDINE
PHOSPHORYLASE

(Bos taurus) 		PF01048
(PNP_UDP_1) 		10 THR A 140
GLY A 142
PHE A 212
GLN A 216
ARG A 218
GLU A 247
MET A 248
LEU A 271
LEU A 272
ILE A 280
 SO4  A 311 ( 3.1A)
URA  A 312 (-3.3A)
URA  A 312 (-4.5A)
URA  A 312 (-3.3A)
URA  A 312 (-2.9A)
R2B  A 313 ( 4.4A)
URA  A 312 ( 3.7A)
None
None
None
 0.18A 3kvrA-3kvyA:
49.5		 3kvrA-3kvyA:
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.
3lez BETA-LACTAMASE

(Oceanobacillus
iheyensis) 		PF13354
(Beta-lactamase2) 		5 THR A 146
GLY A 148
LEU A 150
LEU A 151
ILE A 135
 None
 1.14A 3kvrA-3lezA:
undetectable		 3kvrA-3lezA:
23.53
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.
3lpp SUCRASE-ISOMALTASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		5 GLY A 735
GLU A 733
LEU A 758
LEU A 848
ILE A 784
 PEG  A7001 ( 4.0A)
None
None
None
PEG  A7001 (-4.5A)
 1.26A 3kvrA-3lppA:
undetectable		 3kvrA-3lppA:
14.56
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.
3ocj PUTATIVE EXPORTED
PROTEIN

(Bordetella
parapertussis) 		PF13847
(Methyltransf_31) 		5 GLY A  54
GLU A  85
LEU A  57
LEU A  58
ILE A 258
 PLM  A 305 (-3.5A)
None
None
None
None
 1.31A 3kvrA-3ocjA:
undetectable		 3kvrA-3ocjA:
23.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3p0f URIDINE
PHOSPHORYLASE 2

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		5 THR A 147
GLY A 149
LEU A 278
LEU A 279
ILE A 287
 BAU  A 400 (-4.5A)
BAU  A 400 (-3.5A)
BAU  A 400 ( 4.4A)
BAU  A 400 ( 4.5A)
BAU  A 400 (-4.6A)
 0.64A 3kvrA-3p0fA:
43.5		 3kvrA-3p0fA:
62.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3p0f URIDINE
PHOSPHORYLASE 2

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		9 THR A 147
GLY A 149
PHE A 219
GLN A 223
ARG A 225
GLU A 254
MET A 255
LEU A 278
LEU A 279
 BAU  A 400 (-4.5A)
BAU  A 400 (-3.5A)
BAU  A 400 (-4.4A)
BAU  A 400 (-3.1A)
BAU  A 400 (-2.8A)
None
BAU  A 400 (-3.9A)
BAU  A 400 ( 4.4A)
BAU  A 400 ( 4.5A)
 0.36A 3kvrA-3p0fA:
43.5		 3kvrA-3p0fA:
62.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pp2 RHO
GTPASE-ACTIVATING
PROTEIN 27

(Homo sapiens) 		PF00169
(PH) 		5 GLY A 530
GLU A 528
LEU A 532
LEU A 561
ILE A 607
 None
 1.25A 3kvrA-3pp2A:
undetectable		 3kvrA-3pp2A:
17.80
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.
3px2 N-METHYLTRANSFERASE

(Streptomyces
fradiae) 		PF13649
(Methyltransf_25) 		5 PHE A 137
GLU A 135
LEU A 130
LEU A 124
ILE A 121
 None
 1.29A 3kvrA-3px2A:
undetectable		 3kvrA-3px2A:
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.
3qpb URIDINE
PHOSPHORYLASE

(Streptococcus
pyogenes) 		PF01048
(PNP_UDP_1) 		5 THR A  97
GLY A  99
PHE A 165
GLU A 196
MET A 197
 R1P  A1254 (-3.0A)
URA  A1255 (-3.2A)
R1P  A1254 ( 4.5A)
R1P  A1254 ( 4.4A)
R1P  A1254 (-3.9A)
 0.42A 3kvrA-3qpbA:
24.6		 3kvrA-3qpbA:
28.44
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.
3s46 ALANINE RACEMASE

(Streptococcus
pneumoniae) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 PHE A 139
GLU A 146
LEU A 151
LEU A 152
ILE A 111
 KCX  A 129 ( 4.5A)
None
None
None
None
 0.91A 3kvrA-3s46A:
undetectable		 3kvrA-3s46A:
22.34
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.
3sqw ATP-DEPENDENT RNA
HELICASE MSS116,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 THR A 558
GLY A 560
LEU A 562
LEU A 563
ILE A 526
 None
 1.05A 3kvrA-3sqwA:
2.4		 3kvrA-3sqwA:
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.
3uav PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Bacillus cereus) 		PF01048
(PNP_UDP_1) 		5 THR A  90
GLY A  92
PHE A 159
GLU A 179
MET A 180
 SO4  A 236 (-3.0A)
None
None
None
None
 0.43A 3kvrA-3uavA:
24.4		 3kvrA-3uavA:
25.24
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.
3wwz D-LACTATE
DEHYDROGENASE
(FERMENTATIVE)

(Pseudomonas
aeruginosa) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 GLY A 111
PHE A 159
GLU A 107
LEU A 112
ILE A 230
 None
 1.33A 3kvrA-3wwzA:
2.9		 3kvrA-3wwzA:
23.90
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.
3zwf ZINC
PHOSPHODIESTERASE
ELAC PROTEIN 1

(Homo sapiens) 		PF00753
(Lactamase_B)
PF12706
(Lactamase_B_2) 		5 THR A  41
GLY A  73
GLU A  39
LEU A  74
LEU A  75
 None
 1.34A 3kvrA-3zwfA:
undetectable		 3kvrA-3zwfA:
22.19
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.
4a27 SYNAPTIC VESICLE
MEMBRANE PROTEIN
VAT-1 HOMOLOG-LIKE

(Homo sapiens) 		PF08240
(ADH_N)
PF13602
(ADH_zinc_N_2) 		5 GLY A 342
PHE A 161
GLU A 338
LEU A 343
ILE A 349
 None
 1.18A 3kvrA-4a27A:
undetectable		 3kvrA-4a27A:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aut DECAPRENYL-PHOSPHORY
L-BETA-D-RIBOFURANOS
E-2-OXIDOREDUCTASE

(Mycolicibacterium
smegmatis) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		5 THR A 213
GLY A 248
PHE A 373
LEU A 216
ILE A 220
 None
 1.13A 3kvrA-4autA:
undetectable		 3kvrA-4autA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bjp PENICILLIN BINDING
PROTEIN
TRANSPEPTIDASE
DOMAIN PROTEIN

(Escherichia
coli) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		5 GLY A 191
PHE A 196
GLU A 193
LEU A 178
ILE A 446
 None
 1.27A 3kvrA-4bjpA:
undetectable		 3kvrA-4bjpA:
20.77
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.
4gt6 CELL SURFACE PROTEIN

(Faecalibacterium
prausnitzii) 		PF13306
(LRR_5) 		5 THR A 208
GLU A 229
LEU A 210
LEU A 233
ILE A 213
 None
EDO  A 905 ( 3.6A)
EDO  A 908 ( 4.8A)
None
EDO  A 908 (-3.0A)
 1.25A 3kvrA-4gt6A:
undetectable		 3kvrA-4gt6A:
21.38
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.
4i1u DEPHOSPHO-COA KINASE

(Burkholderia
vietnamiensis) 		PF01121
(CoaE) 		5 ARG A  37
GLU A  96
LEU A  90
LEU A  44
ILE A  38
 CL  A 304 (-4.4A)
None
None
CL  A 304 (-4.0A)
CL  A 304 (-4.6A)
 1.33A 3kvrA-4i1uA:
2.1		 3kvrA-4i1uA:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ic6 PROTEASE DO-LIKE 8,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 GLY A 381
ARG A 432
GLU A 378
LEU A 439
ILE A 430
 None
 1.17A 3kvrA-4ic6A:
undetectable		 3kvrA-4ic6A:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k6j WINGS APART-LIKE
PROTEIN HOMOLOG

(Homo sapiens) 		PF07814
(WAPL) 		5 GLY A1130
GLN A1134
LEU A1128
LEU A1127
ILE A 989
 None
 1.24A 3kvrA-4k6jA:
undetectable		 3kvrA-4k6jA:
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.
4kd5 ABC-TYPE TRANSPORT
SYSTEM,
MOLYBDENUM-SPECIFIC
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN

(Clostridioides
difficile) 		no annotation 5 THR C 225
PHE C 203
GLU C 166
LEU C 171
LEU C 173
 None
 1.19A 3kvrA-4kd5C:
undetectable		 3kvrA-4kd5C:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m47 DNA POLYMERASE BETA

(Homo sapiens) 		PF10391
(DNA_pol_lambd_f)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		5 THR A 225
GLY A 237
PHE A 146
LEU A 228
ILE A 138
 None
 1.12A 3kvrA-4m47A:
undetectable		 3kvrA-4m47A:
23.66
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.
4m7w PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Leptotrichia
buccalis) 		PF01048
(PNP_UDP_1) 		5 THR A  91
GLY A  93
PHE A 160
GLU A 180
MET A 181
 PO4  A 400 (-3.5A)
None
None
None
None
 0.68A 3kvrA-4m7wA:
25.6		 3kvrA-4m7wA:
27.50
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.
4mp4 GLUTATHIONE
S-TRANSFERASE

(Acinetobacter
baumannii) 		PF13417
(GST_N_3)
PF14834
(GST_C_4) 		5 THR A  22
GLY A  26
LEU A  77
LEU A  80
ILE A  76
 None
 1.31A 3kvrA-4mp4A:
undetectable		 3kvrA-4mp4A:
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.
4nk5 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Candidatus
Liberibacter
asiaticus) 		PF13561
(adh_short_C2) 		5 GLY A  10
PHE A  60
LEU A  11
LEU A  86
ILE A  79
 None
 1.23A 3kvrA-4nk5A:
undetectable		 3kvrA-4nk5A:
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.
4nn3 TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Desulfovibrio
salexigens) 		PF03480
(DctP) 		5 THR A 231
GLN A 278
GLU A 233
LEU A 229
ILE A 285
 None
 1.34A 3kvrA-4nn3A:
undetectable		 3kvrA-4nn3A:
24.59
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.
4on1 PUTATIVE
METALLOPROTEASE II

(Bacteroides
fragilis) 		PF00413
(Peptidase_M10)
PF16376
(fragilysinNterm) 		5 GLY A 354
PHE A 222
LEU A 356
LEU A 357
ILE A 324
 None
 1.31A 3kvrA-4on1A:
undetectable		 3kvrA-4on1A:
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.
4q8r PHOSPHATE ABC
TRANSPORTER,
PHOSPHATE-BINDING
PROTEIN

(Clostridium
perfringens) 		PF12849
(PBP_like_2) 		5 GLY A 140
PHE A 135
GLU A 137
LEU A  96
ILE A  99
 None
 1.26A 3kvrA-4q8rA:
undetectable		 3kvrA-4q8rA:
19.81
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.
4r1d UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 GLY B  64
GLN A 110
GLU A 104
LEU B  62
ILE B  67
 None
 1.20A 3kvrA-4r1dB:
undetectable		 3kvrA-4r1dB:
21.99
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.
4r2w URIDINE
PHOSPHORYLASE

(Shewanella
oneidensis) 		PF01048
(PNP_UDP_1) 		5 PHE A 159
GLN A 163
ARG A 165
MET A 194
ILE A 225
 None
None
None
GOL  A 303 (-3.5A)
None
 1.20A 3kvrA-4r2wA:
25.8		 3kvrA-4r2wA:
27.78
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.
4r2w URIDINE
PHOSPHORYLASE

(Shewanella
oneidensis) 		PF01048
(PNP_UDP_1) 		7 THR A  91
GLY A  93
PHE A 159
GLN A 163
ARG A 165
GLU A 193
MET A 194
 SO4  A 302 ( 3.0A)
None
None
None
None
GOL  A 303 (-4.9A)
GOL  A 303 (-3.5A)
 0.30A 3kvrA-4r2wA:
25.8		 3kvrA-4r2wA:
27.78
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.
4r31 URIDINE
PHOSPHORYLASE

(Actinobacillus
succinogenes) 		PF01048
(PNP_UDP_1) 		6 GLY A  94
PHE A 160
GLN A 164
ARG A 166
GLU A 194
MET A 195
 None
GOL  A 301 (-4.6A)
None
None
None
GOL  A 301 (-4.0A)
 0.71A 3kvrA-4r31A:
25.7		 3kvrA-4r31A:
27.61
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.
4tym PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Streptococcus
agalactiae) 		PF01048
(PNP_UDP_1) 		5 THR A 112
GLY A 114
PHE A 181
GLU A 201
MET A 202
 SO4  A 301 (-3.7A)
None
None
None
None
 0.68A 3kvrA-4tymA:
25.2		 3kvrA-4tymA:
27.02
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.
4tz0 ATP-DEPENDENT RNA
HELICASE MSS116,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 THR A 558
GLY A 560
LEU A 562
LEU A 563
ILE A 526
 None
 1.08A 3kvrA-4tz0A:
2.3		 3kvrA-4tz0A:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u09 LIC12759

(Leptospira
interrogans) 		PF13855
(LRR_8) 		5 GLY A 291
PHE A 286
GLU A 289
LEU A 293
LEU A 316
 None
 0.96A 3kvrA-4u09A:
undetectable		 3kvrA-4u09A:
19.85
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.
4uuy VACUOLAR MEMBRANE
PROTEIN PEP3

(Saccharomyces
cerevisiae) 		PF05131
(Pep3_Vps18) 		5 THR A 137
PHE A 115
GLU A 129
LEU A  96
ILE A  99
 None
 1.22A 3kvrA-4uuyA:
undetectable		 3kvrA-4uuyA:
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.
4ynn PROTEASE DO

(Legionella
pneumophila) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 GLY A 284
ARG A 324
LEU A 285
LEU A 331
ILE A 322
 None
 1.29A 3kvrA-4ynnA:
undetectable		 3kvrA-4ynnA:
20.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cyf PUTATIVE URIDINE
PHOSPHORYLASE

(Schistosoma
mansoni) 		PF01048
(PNP_UDP_1) 		5 THR A 124
PHE A 197
ARG A 203
GLU A 232
MET A 233
 FLC  A 301 (-3.7A)
None
None
None
None
 0.38A 3kvrA-5cyfA:
41.2		 3kvrA-5cyfA:
38.71
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.
5ddz RICIN

(Ricinus
communis) 		PF00161
(RIP) 		5 PHE A  24
GLU A  61
LEU A  72
LEU A  74
ILE A 175
 None
 1.25A 3kvrA-5ddzA:
undetectable		 3kvrA-5ddzA:
22.90
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.
5evl BETA-LACTAMASE

(Chromobacterium
violaceum) 		PF00144
(Beta-lactamase) 		5 GLY A 224
GLU A 176
MET A 175
LEU A  63
ILE A  66
 None
 1.30A 3kvrA-5evlA:
undetectable		 3kvrA-5evlA:
22.94
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.
5fmt FLAGELLAR ASSOCIATED
PROTEIN

(Chlamydomonas
reinhardtii) 		PF10243
(MIP-T3) 		5 THR A   8
GLY A 114
PHE A  19
LEU A 110
LEU A 113
 None
 1.30A 3kvrA-5fmtA:
undetectable		 3kvrA-5fmtA:
16.89
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.
5g06 EXOSOME COMPLEX
COMPONENT RRP42

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		5 THR E  94
GLU E  93
LEU E  98
LEU E  99
ILE E 138
 None
 1.03A 3kvrA-5g06E:
undetectable		 3kvrA-5g06E:
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.
5h7d PUTRESCINE
AMINOTRANSFERASE,IMM
UNOGLOBULIN
G-BINDING PROTEIN A
ZPA963,CALMODULIN

(Caenorhabditis
elegans;
Escherichia
coli;
Staphylococcus
aureus;
synthetic
construct) 		PF00202
(Aminotran_3)
PF02216
(B)
PF13499
(EF-hand_7) 		5 THR E 109
PHE A 458
GLU E 111
LEU E 134
ILE E 131
 None
 1.15A 3kvrA-5h7dE:
undetectable		 3kvrA-5h7dE:
16.83
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.
5hqj PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Paraburkholderia
graminis) 		PF13407
(Peripla_BP_4) 		5 THR A 144
GLY A 146
PHE A 217
GLU A 143
LEU A 149
 None
 1.26A 3kvrA-5hqjA:
2.7		 3kvrA-5hqjA:
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.
5iwh ENDORIBONUCLEASE
HIGB

(Proteus
vulgaris) 		PF05015
(HigB-like_toxin) 		5 THR A  19
GLY A   9
LEU A  13
LEU A  10
ILE A  30
 None
 1.06A 3kvrA-5iwhA:
undetectable		 3kvrA-5iwhA:
16.90
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.
5kta FDHC

(Acinetobacter
nosocomialis) 		PF13302
(Acetyltransf_3) 		5 THR A 122
GLY A 119
PHE A  66
GLU A 117
LEU A 123
 None
 1.27A 3kvrA-5ktaA:
undetectable		 3kvrA-5ktaA:
18.33
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.
5lhv URIDINE
PHOSPHORYLASE

(Vibrio cholerae) 		PF01048
(PNP_UDP_1) 		6 PHE A 161
GLN A 165
ARG A 167
GLU A 195
MET A 196
ILE A 220
 URI  A 303 (-4.3A)
URA  A 304 ( 2.9A)
URA  A 304 ( 2.9A)
URI  A 303 ( 4.6A)
URI  A 303 ( 3.7A)
URA  A 304 (-4.3A)
 1.18A 3kvrA-5lhvA:
26.1		 3kvrA-5lhvA:
25.00
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.
5lhv URIDINE
PHOSPHORYLASE

(Vibrio cholerae) 		PF01048
(PNP_UDP_1) 		7 THR A  93
GLY A  95
PHE A 161
GLN A 165
ARG A 167
GLU A 195
MET A 196
 SO4  A 301 ( 2.9A)
URI  A 303 ( 3.4A)
URI  A 303 (-4.3A)
URA  A 304 ( 2.9A)
URA  A 304 ( 2.9A)
URI  A 303 ( 4.6A)
URI  A 303 ( 3.7A)
 0.33A 3kvrA-5lhvA:
26.1		 3kvrA-5lhvA:
25.00
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.
5lkn NEURAL CELL ADHESION
MOLECULE 1

(Homo sapiens) 		PF00041
(fn3) 		5 PHE A 687
GLU A 670
LEU A 663
LEU A 660
ILE A 617
 None
 1.31A 3kvrA-5lknA:
undetectable		 3kvrA-5lknA:
14.47
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.
5lmg DNA TOPOISOMERASE
2-ASSOCIATED PROTEIN
PAT1

(Saccharomyces
cerevisiae) 		PF09770
(PAT1) 		5 GLY A 610
GLU A 607
LEU A 612
LEU A 613
ILE A 665
 None
 1.03A 3kvrA-5lmgA:
undetectable		 3kvrA-5lmgA:
20.87
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.
5loh SERINE/THREONINE-PRO
TEIN KINASE
GREATWALL,SERINE/THR
EONINE-PROTEIN
KINASE GREATWALL

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE A 835
GLU A 828
LEU A 764
LEU A 768
ILE A 137
 None
 1.08A 3kvrA-5lohA:
undetectable		 3kvrA-5lohA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mdn DNA POLYMERASE

(Pyrobaculum
calidifontis) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 THR A 599
GLY A 411
LEU A 597
LEU A 412
ILE A 641
 None
 1.21A 3kvrA-5mdnA:
undetectable		 3kvrA-5mdnA:
17.26
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.
5mtz RIBONUCLEASE Z

(Saccharomyces
cerevisiae) 		PF13691
(Lactamase_B_4) 		5 PHE A 521
GLU A 555
LEU A 488
LEU A 471
ILE A 469
 None
 1.30A 3kvrA-5mtzA:
undetectable		 3kvrA-5mtzA:
16.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ojs TRANSCRIPTION-ASSOCI
ATED PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT) 		5 THR T3241
GLU T3243
LEU T3288
LEU T3287
ILE T3292
 None
 1.20A 3kvrA-5ojsT:
undetectable		 3kvrA-5ojsT:
6.29
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.
5uqj U6 SNRNA
PHOSPHODIESTERASE

(Saccharomyces
cerevisiae) 		PF09749
(HVSL) 		5 THR A 254
GLY A 256
GLU A 253
LEU A 258
LEU A 259
 None
 1.08A 3kvrA-5uqjA:
undetectable		 3kvrA-5uqjA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vgz 26S PROTEASOME
REGULATORY SUBUNIT
10B

(Homo sapiens) 		no annotation 5 THR E  96
GLY E  58
PHE E  69
GLU E  59
ILE E 107
 None
 1.32A 3kvrA-5vgzE:
undetectable		 3kvrA-5vgzE:
16.50
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.
5x0n LYSR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Vibrio
vulnificus) 		PF03466
(LysR_substrate) 		5 THR A  97
PHE A 281
MET A 266
LEU A 124
ILE A 122
 None
 1.23A 3kvrA-5x0nA:
undetectable		 3kvrA-5x0nA:
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.
6c9m N-ALPHA-ACETYLTRANSF
ERASE 15, NATA
AUXILIARY SUBUNIT

(Homo sapiens) 		no annotation 5 THR A 229
GLY A 231
GLU A 228
LEU A 233
LEU A 234
 None
 1.16A 3kvrA-6c9mA:
undetectable		 3kvrA-6c9mA:
15.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fv5 QUEUINE
TRNA-RIBOSYLTRANSFER
ASE ACCESSORY
SUBUNIT 2

(Mus musculus) 		no annotation 5 GLY A 283
GLU A 332
LEU A 335
LEU A 368
ILE A 364
 None
 1.31A 3kvrA-6fv5A:
undetectable		 3kvrA-6fv5A:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6g7x -

(-) 		no annotation 5 THR A  90
GLY A  92
PHE A 159
GLU A 179
MET A 180
 PO4  A 304 (-2.8A)
IMD  A 302 ( 4.2A)
IMD  A 302 (-4.4A)
None
IMD  A 302 (-4.6A)
 0.42A 3kvrA-6g7xA:
19.5		 3kvrA-6g7xA:
undetectable