SIMILAR PATTERNS OF AMINO ACIDS FOR 5LF7_K_6V8K305

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.
1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE

(Streptomyces
clavuligerus) 		PF03171
(2OG-FeII_Oxy) 		5 ALA A 230
ALA A 228
VAL A 137
GLY A 235
GLY A 236
 None
 0.94A 5lf7K-1e5iA:
undetectable
5lf7L-1e5iA:
undetectable		 5lf7K-1e5iA:
23.51
5lf7L-1e5iA:
20.67
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.
1ewr DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 ALA A 228
ALA A 226
VAL A 150
GLY A 233
GLY A 234
 None
 0.95A 5lf7K-1ewrA:
undetectable
5lf7L-1ewrA:
undetectable		 5lf7K-1ewrA:
14.72
5lf7L-1ewrA:
15.43
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.
1gyc LACCASE 2

(Trametes
versicolor) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 ALA A 386
THR A 387
ALA A 388
GLY A 392
ALA A 393
 None
None
None
IPA  A1513 ( 3.8A)
None
 0.92A 5lf7K-1gycA:
undetectable
5lf7L-1gycA:
undetectable		 5lf7K-1gycA:
16.63
5lf7L-1gycA:
18.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1j2q PROTEASOME BETA
SUBUNIT

(Archaeoglobus
fulgidus) 		PF00227
(Proteasome) 		5 THR H   1
ALA H  20
THR H  21
LYS H  33
GLY H  47
 CIB  H1001 (-1.9A)
CIB  H1001 (-3.8A)
CIB  H1001 (-4.5A)
CIB  H1001 (-4.0A)
CIB  H1001 (-4.4A)
 0.28A 5lf7K-1j2qH:
30.3
5lf7L-1j2qH:
26.5		 5lf7K-1j2qH:
33.01
5lf7L-1j2qH:
29.91
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 ALA A 228
ALA A 226
VAL A 150
GLY A 233
GLY A 234
 None
 0.81A 5lf7K-1nneA:
undetectable
5lf7L-1nneA:
undetectable		 5lf7K-1nneA:
14.49
5lf7L-1nneA:
14.23
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.
1pzs SUPEROXIDE DISMUTASE
[CU-ZN]

(Mycobacterium
tuberculosis) 		PF00080
(Sod_Cu) 		5 ALA A 122
THR A 121
GLY A  74
GLY A  73
ALA A  72
 None
 0.80A 5lf7K-1pzsA:
undetectable
5lf7L-1pzsA:
undetectable		 5lf7K-1pzsA:
22.27
5lf7L-1pzsA:
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.
1q5q PROTEASOME BETA-TYPE
SUBUNIT 1

(Rhodococcus
erythropolis) 		PF00227
(Proteasome) 		5 ALA H  20
THR H  21
VAL H  31
LYS H  33
GLY H  47
 None
 0.65A 5lf7K-1q5qH:
26.8
5lf7L-1q5qH:
23.5		 5lf7K-1q5qH:
29.57
5lf7L-1q5qH:
24.41
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.
1q5q PROTEASOME BETA-TYPE
SUBUNIT 1

(Rhodococcus
erythropolis) 		PF00227
(Proteasome) 		7 THR H   1
ALA H  20
THR H  21
VAL H  31
LYS H  33
GLY H  47
ALA H  49
 None
 0.50A 5lf7K-1q5qH:
26.8
5lf7L-1q5qH:
23.5		 5lf7K-1q5qH:
29.57
5lf7L-1q5qH:
24.41
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.
1q5r PROTEASOME BETA-TYPE
SUBUNIT 1

(Rhodococcus
erythropolis) 		PF00227
(Proteasome) 		5 ALA H  20
THR H  21
VAL H  31
GLY H  47
ALA H  49
 None
 0.29A 5lf7K-1q5rH:
24.6
5lf7L-1q5rH:
23.2		 5lf7K-1q5rH:
29.13
5lf7L-1q5rH:
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.
1r66 TDP-GLUCOSE-4,6-DEHY
DRATASE

(Streptomyces
venezuelae) 		PF16363
(GDP_Man_Dehyd) 		5 ALA A 228
GLY A 234
GLY A 233
ALA A 232
ASP A  27
 None
 0.93A 5lf7K-1r66A:
undetectable
5lf7L-1r66A:
undetectable		 5lf7K-1r66A:
23.23
5lf7L-1r66A:
19.30
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.
1yzy HYPOTHETICAL PROTEIN
HI1011

(Haemophilus
influenzae) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		5 ALA A   5
VAL A  44
GLY A 218
GLY A 219
ASP A  13
 None
 0.93A 5lf7K-1yzyA:
undetectable
5lf7L-1yzyA:
undetectable		 5lf7K-1yzyA:
20.26
5lf7L-1yzyA:
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.
1zem XYLITOL
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF13561
(adh_short_C2) 		6 ALA A  24
THR A  23
VAL A  51
GLY A  17
GLY A  16
ALA A  15
 None
None
None
NAD  A2263 (-3.1A)
NAD  A2263 (-3.9A)
None
 1.42A 5lf7K-1zemA:
undetectable
5lf7L-1zemA:
undetectable		 5lf7K-1zemA:
22.14
5lf7L-1zemA:
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.
2d0d 2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		5 ALA A 111
THR A 112
ALA A 113
GLY A 105
GLY A 106
 None
 0.93A 5lf7K-2d0dA:
undetectable
5lf7L-2d0dA:
undetectable		 5lf7K-2d0dA:
19.73
5lf7L-2d0dA:
21.43
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.
2fhg PROTEASOME, BETA
SUBUNIT

(Mycobacterium
tuberculosis) 		no annotation 6 THR H 301
THR H 321
VAL H 331
LYS H 333
GLY H 347
ALA H 349
 None
 0.48A 5lf7K-2fhgH:
26.0
5lf7L-2fhgH:
23.2		 5lf7K-2fhgH:
29.34
5lf7L-2fhgH:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fvm DIHYDROPYRIMIDINASE

(Lachancea
kluyveri) 		PF01979
(Amidohydro_1) 		5 THR A  83
ALA A  82
GLY A  90
GLY A  89
ALA A  88
 None
 0.96A 5lf7K-2fvmA:
undetectable
5lf7L-2fvmA:
undetectable		 5lf7K-2fvmA:
18.65
5lf7L-2fvmA:
16.73
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.
2gfi PHYTASE

(Debaryomyces
castellii) 		PF00328
(His_Phos_2) 		5 THR A 174
VAL A 163
GLY A 144
GLY A 181
ALA A 179
 None
 0.95A 5lf7K-2gfiA:
undetectable
5lf7L-2gfiA:
undetectable		 5lf7K-2gfiA:
16.11
5lf7L-2gfiA:
18.56
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.
2h0q SUPPRESSOR OF T-CELL
RECEPTOR SIGNALING 1

(Mus musculus) 		PF00300
(His_Phos_1) 		5 ALA A 467
THR A 466
VAL A 455
GLY A 442
GLY A 473
 None
 0.88A 5lf7K-2h0qA:
undetectable
5lf7L-2h0qA:
undetectable		 5lf7K-2h0qA:
20.59
5lf7L-2h0qA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h9f HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF04303
(PrpF) 		5 ALA A 328
ALA A 346
GLY A 341
GLY A 340
ALA A 339
 None
GOL  A 404 (-4.4A)
None
None
None
 0.95A 5lf7K-2h9fA:
undetectable
5lf7L-2h9fA:
undetectable		 5lf7K-2h9fA:
20.60
5lf7L-2h9fA:
21.41
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.
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima) 		PF00390
(malic)
PF03949
(Malic_M) 		5 ALA A 248
THR A 247
VAL A 208
GLY A 251
ALA A 252
 None
 0.80A 5lf7K-2haeA:
undetectable
5lf7L-2haeA:
undetectable		 5lf7K-2haeA:
22.22
5lf7L-2haeA:
20.94
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.
2ols PHOSPHOENOLPYRUVATE
SYNTHASE

(Neisseria
meningitidis) 		PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C) 		5 THR A 414
ALA A 434
ALA A 365
GLY A 417
GLY A 418
 None
 0.79A 5lf7K-2olsA:
undetectable
5lf7L-2olsA:
undetectable		 5lf7K-2olsA:
14.85
5lf7L-2olsA:
14.32
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.
2p10 MLL9387 PROTEIN

(Mesorhizobium
japonicum) 		PF09370
(PEP_hydrolase) 		5 ALA A  98
VAL A  91
GLY A  32
GLY A  33
ALA A  34
 None
 0.76A 5lf7K-2p10A:
undetectable
5lf7L-2p10A:
undetectable		 5lf7K-2p10A:
23.45
5lf7L-2p10A:
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.
2rbc SUGAR KINASE

(Agrobacterium
fabrum) 		PF00294
(PfkB) 		5 ALA A 294
ALA A 281
GLY A 289
GLY A 290
ASP A 254
 None
EDO  A 331 ( 3.7A)
None
None
None
 0.91A 5lf7K-2rbcA:
undetectable
5lf7L-2rbcA:
undetectable		 5lf7K-2rbcA:
18.60
5lf7L-2rbcA:
24.00
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.
2ri6 2-HYDROXY-6-OXO-6-PH
ENYLHEXA-2,4-DIENOAT
E HYDROLASE

(Paraburkholderia
xenovorans) 		PF12697
(Abhydrolase_6) 		6 ALA A 116
THR A 117
ALA A 118
GLY A  42
GLY A  41
ALA A 112
 None
None
None
MLI  A   2 (-3.5A)
MLI  A   2 (-3.5A)
MLI  A   2 (-3.2A)
 1.41A 5lf7K-2ri6A:
undetectable
5lf7L-2ri6A:
undetectable		 5lf7K-2ri6A:
21.55
5lf7L-2ri6A:
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.
2uun C-PHYCOCYANIN

(Leptolyngbya
sp.) 		PF00502
(Phycobilisome) 		5 ALA B 167
ALA B 169
VAL B  93
GLY B 130
GLY B 132
 None
 0.89A 5lf7K-2uunB:
undetectable
5lf7L-2uunB:
undetectable		 5lf7K-2uunB:
25.36
5lf7L-2uunB:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uun C-PHYCOCYANIN

(Leptolyngbya
sp.) 		PF00502
(Phycobilisome) 		5 ALA B 169
VAL B  93
GLY B 130
GLY B 132
ASP B 165
 None
 0.86A 5lf7K-2uunB:
undetectable
5lf7L-2uunB:
undetectable		 5lf7K-2uunB:
25.36
5lf7L-2uunB:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN

(Azospirillum
brasilense) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 ALA A 567
VAL A 604
GLY A 600
GLY A 599
ALA A 596
 None
 0.95A 5lf7K-2vdcA:
undetectable
5lf7L-2vdcA:
2.8		 5lf7K-2vdcA:
10.05
5lf7L-2vdcA:
9.05
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.
2vre DELTA(3,5)-DELTA(2,4
)-DIENOYL-COA
ISOMERASE

(Homo sapiens) 		PF00378
(ECH_1) 		5 THR A 154
ALA A 155
VAL A 141
GLY A 147
GLY A 148
 None
 0.90A 5lf7K-2vreA:
undetectable
5lf7L-2vreA:
undetectable		 5lf7K-2vreA:
20.31
5lf7L-2vreA:
19.33
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.
2wqd PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Staphylococcus
aureus) 		PF00391
(PEP-utilizers)
PF02896
(PEP-utilizers_C)
PF05524
(PEP-utilisers_N) 		5 THR A 183
ALA A 203
ALA A   9
GLY A 186
GLY A 187
 None
 0.85A 5lf7K-2wqdA:
undetectable
5lf7L-2wqdA:
undetectable		 5lf7K-2wqdA:
15.93
5lf7L-2wqdA:
17.42
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.
2wu0 PHYTASE

(Klebsiella
pneumoniae) 		PF00328
(His_Phos_2) 		5 ALA A 105
THR A 104
ALA A 103
VAL A  93
GLY A 111
 None
 0.91A 5lf7K-2wu0A:
undetectable
5lf7L-2wu0A:
undetectable		 5lf7K-2wu0A:
18.53
5lf7L-2wu0A:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aar ECTONUCLEOSIDE
TRIPHOSPHATE
DIPHOSPHOHYDROLASE I

(Legionella
pneumophila) 		PF01150
(GDA1_CD39) 		5 ALA A 117
THR A 118
ALA A 119
GLY A  54
GLY A  84
 None
 0.92A 5lf7K-3aarA:
undetectable
5lf7L-3aarA:
undetectable		 5lf7K-3aarA:
21.07
5lf7L-3aarA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aar ECTONUCLEOSIDE
TRIPHOSPHATE
DIPHOSPHOHYDROLASE I

(Legionella
pneumophila) 		PF01150
(GDA1_CD39) 		5 ALA A 117
THR A 118
ALA A 119
GLY A  84
ALA A  86
 None
 0.97A 5lf7K-3aarA:
undetectable
5lf7L-3aarA:
undetectable		 5lf7K-3aarA:
21.07
5lf7L-3aarA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3beo UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Bacillus
anthracis) 		PF02350
(Epimerase_2) 		5 THR A 207
ALA A 208
VAL A 300
GLY A 288
GLY A 287
 UDP  A1081 ( 4.9A)
None
None
UDP  A1081 (-3.7A)
UDP  A1081 (-3.7A)
 0.82A 5lf7K-3beoA:
undetectable
5lf7L-3beoA:
undetectable		 5lf7K-3beoA:
18.49
5lf7L-3beoA:
21.18
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.
3c5w PP2A-SPECIFIC
METHYLESTERASE PME-1

(Homo sapiens) 		PF12697
(Abhydrolase_6) 		5 THR P 165
ALA P 166
GLY P 158
GLY P 159
ALA P 160
 None
 0.90A 5lf7K-3c5wP:
undetectable
5lf7L-3c5wP:
undetectable		 5lf7K-3c5wP:
23.70
5lf7L-3c5wP:
19.55
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.
3c7t ECDYSTEROID-PHOSPHAT
E PHOSPHATASE

(Bombyx mori) 		PF00300
(His_Phos_1) 		5 ALA A 165
THR A 164
VAL A 153
GLY A 140
GLY A 171
 None
 0.91A 5lf7K-3c7tA:
undetectable
5lf7L-3c7tA:
undetectable		 5lf7K-3c7tA:
18.22
5lf7L-3c7tA:
24.91
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.
3dqq PUTATIVE TRNA
SYNTHASE

(Salmonella
enterica) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		5 ALA A   8
VAL A  47
GLY A 221
GLY A 222
ASP A  16
 None
 0.93A 5lf7K-3dqqA:
undetectable
5lf7L-3dqqA:
undetectable		 5lf7K-3dqqA:
19.62
5lf7L-3dqqA:
22.44
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.
3e9m OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Enterococcus
faecalis) 		PF01408
(GFO_IDH_MocA) 		5 ALA A 206
VAL A 158
GLY A 170
GLY A 171
ASP A 208
 None
 0.93A 5lf7K-3e9mA:
undetectable
5lf7L-3e9mA:
undetectable		 5lf7K-3e9mA:
19.71
5lf7L-3e9mA:
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.
3gaz ALCOHOL
DEHYDROGENASE
SUPERFAMILY PROTEIN

(Novosphingobium
aromaticivorans) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 180
THR A 181
ALA A 182
VAL A 178
GLY A 164
 None
 0.89A 5lf7K-3gazA:
undetectable
5lf7L-3gazA:
undetectable		 5lf7K-3gazA:
21.28
5lf7L-3gazA:
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.
3h4x PHOSPHATIDYLINOSITOL
-SPECIFIC
PHOSPHOLIPASE C1

(Streptomyces
antibioticus) 		PF16670
(PI-PLC-C1) 		5 ALA A 320
THR A 321
ALA A 322
GLY A 261
ALA A 263
 None
 0.74A 5lf7K-3h4xA:
undetectable
5lf7L-3h4xA:
undetectable		 5lf7K-3h4xA:
21.07
5lf7L-3h4xA:
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.
3i47 ENOYL COA
HYDRATASE/ISOMERASE
(CROTONASE)

(Legionella
pneumophila) 		PF00378
(ECH_1) 		5 ALA A 118
ALA A 120
VAL A 106
GLY A 112
GLY A 113
 None
 0.95A 5lf7K-3i47A:
undetectable
5lf7L-3i47A:
undetectable		 5lf7K-3i47A:
21.43
5lf7L-3i47A:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jwe MGLL PROTEIN

(Homo sapiens) 		PF12146
(Hydrolase_4) 		5 THR A 141
ALA A 142
GLY A 134
GLY A 135
ALA A 136
 None
 0.95A 5lf7K-3jweA:
undetectable
5lf7L-3jweA:
undetectable		 5lf7K-3jweA:
20.31
5lf7L-3jweA:
22.05
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.
3mg6 PROTEASOME COMPONENT
PRE3

(Saccharomyces
cerevisiae) 		no annotation 5 THR N   1
THR N  21
LYS N  33
GLY N  47
ALA N  49
 None
 0.64A 5lf7K-3mg6N:
29.7
5lf7L-3mg6N:
26.8		 5lf7K-3mg6N:
27.23
5lf7L-3mg6N:
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.
3noj 4-CARBOXY-4-HYDROXY-
2-OXOADIPATE
ALDOLASE/OXALOACETAT
E DECARBOXYLASE

(Pseudomonas
putida) 		PF03737
(RraA-like) 		5 THR A 145
VAL A  66
GLY A  98
GLY A 121
ALA A 120
 None
 0.89A 5lf7K-3nojA:
undetectable
5lf7L-3nojA:
undetectable		 5lf7K-3nojA:
24.50
5lf7L-3nojA:
21.09
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.
3ot5 UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Listeria
monocytogenes) 		PF02350
(Epimerase_2) 		5 THR A 206
ALA A 207
VAL A 299
GLY A 287
GLY A 286
 None
 0.87A 5lf7K-3ot5A:
undetectable
5lf7L-3ot5A:
undetectable		 5lf7K-3ot5A:
20.82
5lf7L-3ot5A:
20.35
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.
3pxl LACCASE

(Trametes
hirsuta) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 ALA A 386
THR A 387
ALA A 388
GLY A 392
ALA A 393
 None
 0.91A 5lf7K-3pxlA:
undetectable
5lf7L-3pxlA:
undetectable		 5lf7K-3pxlA:
18.37
5lf7L-3pxlA:
19.66
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.
3r0o CARNITINYL-COA
DEHYDRATASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		5 ALA A 122
ALA A 124
VAL A 110
GLY A 116
GLY A 117
 None
EDO  A 270 (-4.1A)
None
None
None
 0.95A 5lf7K-3r0oA:
undetectable
5lf7L-3r0oA:
undetectable		 5lf7K-3r0oA:
24.82
5lf7L-3r0oA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tbh O-ACETYL SERINE
SULFHYDRYLASE

(Leishmania
donovani) 		PF00291
(PALP) 		6 THR A 298
ALA A 281
VAL A 210
GLY A 275
GLY A 276
ALA A 277
 None
 1.28A 5lf7K-3tbhA:
undetectable
5lf7L-3tbhA:
undetectable		 5lf7K-3tbhA:
22.94
5lf7L-3tbhA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3unf PROTEASOME SUBUNIT
BETA TYPE-10

(Mus musculus) 		PF00227
(Proteasome)
PF12465
(Pr_beta_C) 		6 THR H   1
ALA H  20
THR H  21
LYS H  33
GLY H  47
ALA H  49
 04C  H 301 (-2.5A)
04C  H 301 (-3.9A)
04C  H 301 (-3.9A)
04C  H 301 (-3.5A)
04C  H 301 (-3.7A)
04C  H 301 (-3.6A)
 0.38A 5lf7K-3unfH:
32.0
5lf7L-3unfH:
27.0		 5lf7K-3unfH:
26.52
5lf7L-3unfH:
26.25
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.
3usz EXO-1,3/1,4-BETA-GLU
CANASE

(Pseudoalteromonas
sp. BB1) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		5 ALA A 213
THR A 212
ALA A 211
VAL A 162
ALA A 249
 None
 0.96A 5lf7K-3uszA:
undetectable
5lf7L-3uszA:
undetectable		 5lf7K-3uszA:
13.27
5lf7L-3uszA:
14.06
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.
3wfa ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		5 ALA A 695
GLY A 718
GLY A 717
ALA A 714
ASP A 688
 None
 0.88A 5lf7K-3wfaA:
undetectable
5lf7L-3wfaA:
undetectable		 5lf7K-3wfaA:
14.16
5lf7L-3wfaA:
15.82
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.
3wvs PUTATIVE
MONOOXYGENASE

(Streptomyces
sp. SN-593) 		PF00067
(p450) 		5 ALA A  52
THR A  53
ALA A 321
VAL A 314
GLY A 304
 None
 0.88A 5lf7K-3wvsA:
undetectable
5lf7L-3wvsA:
undetectable		 5lf7K-3wvsA:
19.60
5lf7L-3wvsA:
20.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wxr PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		5 ALA L  20
ALA L  22
VAL L  31
LYS L  33
GLY L  48
 None
 0.85A 5lf7K-3wxrL:
34.9
5lf7L-3wxrL:
24.2		 5lf7K-3wxrL:
65.38
5lf7L-3wxrL:
24.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wxr PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		6 THR L   1
ALA L  20
ALA L  22
VAL L  31
LYS L  33
GLY L  47
 None
 0.51A 5lf7K-3wxrL:
34.9
5lf7L-3wxrL:
24.2		 5lf7K-3wxrL:
65.38
5lf7L-3wxrL:
24.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wxr PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		6 THR L   1
ALA L  20
THR L  21
ALA L  22
VAL L  31
LYS L  33
 None
 0.34A 5lf7K-3wxrL:
34.9
5lf7L-3wxrL:
24.2		 5lf7K-3wxrL:
65.38
5lf7L-3wxrL:
24.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wxr PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		6 THR L   1
ALA L  20
THR L  21
VAL L  31
LYS L  33
GLY L  47
 None
 0.97A 5lf7K-3wxrL:
34.9
5lf7L-3wxrL:
24.2		 5lf7K-3wxrL:
65.38
5lf7L-3wxrL:
24.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wxr PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		7 THR L   1
ALA L  20
VAL L  31
LYS L  33
GLY L  47
GLY L  48
ALA L  49
 None
 0.62A 5lf7K-3wxrL:
34.9
5lf7L-3wxrL:
24.2		 5lf7K-3wxrL:
65.38
5lf7L-3wxrL:
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.
4b45 CELL DIVISION
PROTEIN FTSZ

(Haloferax
volcanii) 		PF00091
(Tubulin) 		6 ALA A 116
ALA A 118
VAL A 129
GLY A 110
GLY A 111
ALA A 112
 None
 1.49A 5lf7K-4b45A:
undetectable
5lf7L-4b45A:
undetectable		 5lf7K-4b45A:
22.22
5lf7L-4b45A:
21.76
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.
4dup QUINONE
OXIDOREDUCTASE

(Rhizobium etli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 175
THR A 176
ALA A 177
VAL A 173
GLY A 159
 None
 0.88A 5lf7K-4dupA:
undetectable
5lf7L-4dupA:
undetectable		 5lf7K-4dupA:
21.83
5lf7L-4dupA:
24.23
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.
4dvj PUTATIVE
ZINC-DEPENDENT
ALCOHOL
DEHYDROGENASE
PROTEIN

(Rhizobium etli) 		PF08240
(ADH_N)
PF13602
(ADH_zinc_N_2) 		5 ALA A 202
THR A 203
ALA A 204
VAL A 200
GLY A 185
 None
 0.80A 5lf7K-4dvjA:
undetectable
5lf7L-4dvjA:
undetectable		 5lf7K-4dvjA:
18.57
5lf7L-4dvjA:
22.22
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.
4e7n SNAKE-VENOM
THROMBIN-LIKE ENZYME

(Gloydius halys) 		PF00089
(Trypsin) 		5 ALA A 227
VAL A 231
GLY A 197
GLY A 196
ASP A 102
 None
 0.89A 5lf7K-4e7nA:
undetectable
5lf7L-4e7nA:
undetectable		 5lf7K-4e7nA:
22.51
5lf7L-4e7nA:
23.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fkz UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Bacillus
subtilis) 		PF02350
(Epimerase_2) 		5 THR A 205
ALA A 206
VAL A 298
GLY A 286
GLY A 285
 UDP  A 402 ( 4.8A)
None
None
UDP  A 402 (-3.5A)
UDP  A 402 (-3.6A)
 0.79A 5lf7K-4fkzA:
undetectable
5lf7L-4fkzA:
undetectable		 5lf7K-4fkzA:
19.79
5lf7L-4fkzA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g4e ATP-DEPENDENT
PROTEASE SUBUNIT
HSLV

(Escherichia
coli) 		PF00227
(Proteasome) 		7 THR A   1
ALA A  20
THR A  21
VAL A  31
LYS A  33
GLY A  48
GLY A  49
 None
 0.75A 5lf7K-4g4eA:
21.7
5lf7L-4g4eA:
18.8		 5lf7K-4g4eA:
26.42
5lf7L-4g4eA:
24.77
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.
4hvl MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
thermoresistibile) 		PF00082
(Peptidase_S8) 		5 ALA A 367
ALA A 365
GLY A 379
GLY A 300
ALA A 301
 None
 0.90A 5lf7K-4hvlA:
undetectable
5lf7L-4hvlA:
undetectable		 5lf7K-4hvlA:
21.59
5lf7L-4hvlA:
21.48
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.
4ihe THNT PROTEIN

(Streptomyces
cattleya) 		PF03576
(Peptidase_S58) 		5 THR A 283
ALA A 282
GLY A 196
GLY A 185
ALA A 184
 None
 0.94A 5lf7K-4iheA:
undetectable
5lf7L-4iheA:
undetectable		 5lf7K-4iheA:
19.95
5lf7L-4iheA:
18.41
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.
4jhm MANDELATE RACEMASE /
MUCONATE LACTONIZING
ENZYME, C-TERMINAL
DOMAIN PROTEIN

(Pseudovibrio
sp. JE062) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 THR A  52
ALA A  51
GLY A 275
GLY A 276
ALA A 271
 None
 0.58A 5lf7K-4jhmA:
undetectable
5lf7L-4jhmA:
undetectable		 5lf7K-4jhmA:
17.53
5lf7L-4jhmA:
19.31
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.
4k5r OXYGENASE

(Streptomyces
argillaceus) 		PF01494
(FAD_binding_3) 		5 ALA A 124
ALA A  28
GLY A  35
GLY A  34
ALA A  33
 None
 0.94A 5lf7K-4k5rA:
undetectable
5lf7L-4k5rA:
undetectable		 5lf7K-4k5rA:
18.10
5lf7L-4k5rA:
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.
4ldn PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Aliivibrio
fischeri) 		PF01048
(PNP_UDP_1) 		5 ALA A 130
THR A 129
ALA A 128
GLY A 152
ALA A 107
 None
 0.88A 5lf7K-4ldnA:
undetectable
5lf7L-4ldnA:
undetectable		 5lf7K-4ldnA:
23.79
5lf7L-4ldnA:
23.91
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.
4m1z MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		5 ALA A 367
ALA A 365
GLY A 379
GLY A 300
ALA A 301
 None
 0.94A 5lf7K-4m1zA:
undetectable
5lf7L-4m1zA:
undetectable		 5lf7K-4m1zA:
22.14
5lf7L-4m1zA:
23.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qv9 PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		9 THR K   1
ALA K  20
THR K  21
ALA K  22
VAL K  31
LYS K  33
GLY K  47
GLY K  48
ALA K  49
 None
 0.69A 5lf7K-4qv9K:
35.1
5lf7L-4qv9K:
24.5		 5lf7K-4qv9K:
64.90
5lf7L-4qv9K:
26.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qv9 PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		6 THR K   1
ALA K  20
THR K  21
VAL K  31
LYS K  33
GLY K  47
 None
 0.94A 5lf7K-4qv9K:
35.1
5lf7L-4qv9K:
24.5		 5lf7K-4qv9K:
64.90
5lf7L-4qv9K:
26.89
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.
4wpx CELL DIVISION
CONTROL PROTEIN
31-LIKE PROTEIN

(Chaetomium
thermophilum) 		PF00036
(EF-hand_1)
PF13499
(EF-hand_7) 		6 ALA A  96
THR A  95
ALA A  94
VAL A  51
GLY A 101
ALA A 100
 None
 1.39A 5lf7K-4wpxA:
undetectable
5lf7L-4wpxA:
undetectable		 5lf7K-4wpxA:
19.35
5lf7L-4wpxA:
23.28
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.
4yle PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Burkholderia
multivorans) 		PF13407
(Peripla_BP_4) 		6 ALA A 275
THR A 274
ALA A 273
VAL A 311
GLY A 230
ALA A 150
 None
 1.11A 5lf7K-4yleA:
undetectable
5lf7L-4yleA:
undetectable		 5lf7K-4yleA:
22.76
5lf7L-4yleA:
22.71
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.
5bw4 16S RRNA
(ADENINE(1408)-N(1))
-METHYLTRANSFERASE

(Catenulispora
acidiphila) 		no annotation 5 THR A  70
ALA A  71
GLY A  81
GLY A  82
ALA A  83
 None
 0.94A 5lf7K-5bw4A:
undetectable
5lf7L-5bw4A:
undetectable		 5lf7K-5bw4A:
20.70
5lf7L-5bw4A:
22.14
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.
5enz UDP-GLCNAC
2-EPIMERASE

(Staphylococcus
aureus) 		PF02350
(Epimerase_2) 		5 THR A 203
ALA A 204
VAL A 296
GLY A 284
GLY A 283
 UDP  A 401 ( 4.4A)
None
None
UDP  A 401 (-3.5A)
UDP  A 401 (-3.8A)
 0.86A 5lf7K-5enzA:
undetectable
5lf7L-5enzA:
undetectable		 5lf7K-5enzA:
20.00
5lf7L-5enzA:
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.
5fg9 PROTEASOME SUBUNIT
BETA TYPE-2

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome)
PF12465
(Pr_beta_C) 		5 THR H   1
THR H  21
LYS H  33
GLY H  47
ALA H  49
 None
 0.48A 5lf7K-5fg9H:
28.3
5lf7L-5fg9H:
24.7		 5lf7K-5fg9H:
28.27
5lf7L-5fg9H:
24.81
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.
5fmg PROTEASOME SUBUNIT
BETA TYPE

(Plasmodium
falciparum) 		PF00227
(Proteasome) 		6 THR I   1
ALA I  20
THR I  21
LYS I  33
GLY I  47
ALA I  49
 7F1  I 300 (-2.7A)
7F1  I 300 (-3.6A)
None
7F1  I 300 (-4.7A)
7F1  I 300 (-3.8A)
7F1  I 300 (-3.5A)
 0.74A 5lf7K-5fmgI:
29.1
5lf7L-5fmgI:
25.0		 5lf7K-5fmgI:
25.32
5lf7L-5fmgI:
24.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fmg PROTEASOME SUBUNIT
BETA TYPE

(Plasmodium
falciparum) 		PF00227
(Proteasome) 		6 THR L   1
ALA L  20
VAL L  31
GLY L  47
GLY L  48
ALA L  49
 None
 0.73A 5lf7K-5fmgL:
29.5
5lf7L-5fmgL:
25.1		 5lf7K-5fmgL:
52.91
5lf7L-5fmgL:
27.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fmg PROTEASOME SUBUNIT
BETA TYPE

(Plasmodium
falciparum) 		PF00227
(Proteasome) 		6 THR L   1
VAL L  31
MET L  45
GLY L  47
GLY L  48
ALA L  49
 None
 0.76A 5lf7K-5fmgL:
29.5
5lf7L-5fmgL:
25.1		 5lf7K-5fmgL:
52.91
5lf7L-5fmgL:
27.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fmg PROTEASOME SUBUNIT
BETA TYPE
BETA3 PROTEASOME
SUBUNIT, PUTATIVE

(Plasmodium
falciparum;
Plasmodium
falciparum) 		PF00227
(Proteasome)
PF00227
(Proteasome) 		6 THR I   1
ALA I  20
THR I  21
LYS I  33
GLY I  47
ASP J 138
 7F1  I 300 (-2.7A)
7F1  I 300 (-3.6A)
None
7F1  I 300 (-4.7A)
7F1  I 300 (-3.8A)
7F1  I 300 (-2.6A)
 1.09A 5lf7K-5fmgI:
29.1
5lf7L-5fmgI:
25.0		 5lf7K-5fmgI:
25.32
5lf7L-5fmgI:
24.19
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.
5gxf ACRYLYL-COA
REDUCTASE ACUI

(Ruegeria
pomeroyi) 		PF00107
(ADH_zinc_N) 		6 ALA A 166
THR A 167
ALA A 168
VAL A 221
GLY A 160
GLY A 161
 None
 1.23A 5lf7K-5gxfA:
undetectable
5lf7L-5gxfA:
undetectable		 5lf7K-5gxfA:
21.45
5lf7L-5gxfA:
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.
5igp MACROLIDE
2'-PHOSPHOTRANSFERAS
E

(Escherichia
coli) 		PF01636
(APH) 		5 ALA A 128
ALA A 130
GLY A 256
GLY A 255
ALA A 254
 None
 0.95A 5lf7K-5igpA:
undetectable
5lf7L-5igpA:
undetectable		 5lf7K-5igpA:
19.61
5lf7L-5igpA:
19.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5l5w PROTEASOME SUBUNIT
BETA
TYPE-5,PROTEASOME
SUBUNIT BETA TYPE-5

(Saccharomyces
cerevisiae;
Homo sapiens) 		PF00227
(Proteasome) 		7 THR K   1
ALA K  20
THR K  21
ALA K  22
VAL K  31
LYS K  33
GLY K  47
 None
 0.53A 5lf7K-5l5wK:
35.7
5lf7L-5l5wK:
24.7		 5lf7K-5l5wK:
83.09
5lf7L-5l5wK:
24.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5l5w PROTEASOME SUBUNIT
BETA
TYPE-5,PROTEASOME
SUBUNIT BETA TYPE-5

(Saccharomyces
cerevisiae;
Homo sapiens) 		PF00227
(Proteasome) 		6 THR K   1
ALA K  20
THR K  21
VAL K  31
LYS K  33
GLY K  47
 None
 1.01A 5lf7K-5l5wK:
35.7
5lf7L-5l5wK:
24.7		 5lf7K-5l5wK:
83.09
5lf7L-5l5wK:
24.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5l5w PROTEASOME SUBUNIT
BETA
TYPE-5,PROTEASOME
SUBUNIT BETA TYPE-5

(Saccharomyces
cerevisiae;
Homo sapiens) 		PF00227
(Proteasome) 		7 THR K   1
ALA K  20
VAL K  31
LYS K  33
GLY K  47
GLY K  48
ALA K  49
 None
 0.59A 5lf7K-5l5wK:
35.7
5lf7L-5l5wK:
24.7		 5lf7K-5l5wK:
83.09
5lf7L-5l5wK:
24.02
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.
5lh9 OMEGA TRANSAMINASE

(Pseudomonas sp.) 		PF00202
(Aminotran_3) 		5 ALA A 122
ALA A 118
GLY A 154
GLY A 155
ASP A 255
 None
None
None
None
PLP  A1001 (-2.4A)
 0.89A 5lf7K-5lh9A:
undetectable
5lf7L-5lh9A:
undetectable		 5lf7K-5lh9A:
21.28
5lf7L-5lh9A:
17.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5m2b PROTEASOME SUBUNIT
BETA
TYPE-8,PROTEASOME
SUBUNIT BETA TYPE-5

(Saccharomyces
cerevisiae;
Homo sapiens) 		PF00227
(Proteasome) 		7 THR K   1
ALA K  20
ALA K  22
VAL K  31
LYS K  33
MET K  45
GLY K  47
 7DX  K 301 (-3.3A)
7DX  K 301 ( 4.0A)
None
7DX  K 301 (-4.2A)
7DX  K 301 (-4.2A)
7DX  K 301 ( 3.8A)
7DX  K 301 (-3.8A)
 0.48A 5lf7K-5m2bK:
35.6
5lf7L-5m2bK:
25.1		 5lf7K-5m2bK:
66.18
5lf7L-5m2bK:
25.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5m2b PROTEASOME SUBUNIT
BETA
TYPE-8,PROTEASOME
SUBUNIT BETA TYPE-5

(Saccharomyces
cerevisiae;
Homo sapiens) 		PF00227
(Proteasome) 		6 THR K   1
ALA K  20
VAL K  31
LYS K  33
MET K  45
GLY K  47
 7DX  K 301 (-3.3A)
7DX  K 301 ( 4.0A)
7DX  K 301 (-4.2A)
7DX  K 301 (-4.2A)
7DX  K 301 ( 3.8A)
7DX  K 301 (-3.8A)
 0.94A 5lf7K-5m2bK:
35.6
5lf7L-5m2bK:
25.1		 5lf7K-5m2bK:
66.18
5lf7L-5m2bK:
25.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5m2b PROTEASOME SUBUNIT
BETA
TYPE-8,PROTEASOME
SUBUNIT BETA TYPE-5

(Saccharomyces
cerevisiae;
Homo sapiens) 		PF00227
(Proteasome) 		7 THR K   1
ALA K  20
VAL K  31
LYS K  33
MET K  45
GLY K  47
ALA K  49
 7DX  K 301 (-3.3A)
7DX  K 301 ( 4.0A)
7DX  K 301 (-4.2A)
7DX  K 301 (-4.2A)
7DX  K 301 ( 3.8A)
7DX  K 301 (-3.8A)
7DX  K 301 (-3.2A)
 0.60A 5lf7K-5m2bK:
35.6
5lf7L-5m2bK:
25.1		 5lf7K-5m2bK:
66.18
5lf7L-5m2bK:
25.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5t0g PROTEASOME SUBUNIT
BETA TYPE-5

(Homo sapiens) 		PF00227
(Proteasome) 		8 THR R   1
ALA R  20
ALA R  22
VAL R  31
LYS R  33
GLY R  47
GLY R  48
ALA R  49
 None
 1.10A 5lf7K-5t0gR:
33.3
5lf7L-5t0gR:
24.8		 5lf7K-5t0gR:
100.00
5lf7L-5t0gR:
23.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5t0g PROTEASOME SUBUNIT
BETA TYPE-5

(Homo sapiens) 		PF00227
(Proteasome) 		7 THR R   1
ALA R  20
THR R  21
ALA R  22
VAL R  31
LYS R  33
GLY R  47
 None
 1.33A 5lf7K-5t0gR:
33.3
5lf7L-5t0gR:
24.8		 5lf7K-5t0gR:
100.00
5lf7L-5t0gR:
23.68
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.
5tou PHYCOCYANIN BETA-1
SUBUNIT

(Pseudanabaena
sp. lw0831) 		no annotation 5 ALA D 167
ALA D 169
VAL D  93
GLY D 130
GLY D 132
 None
 0.89A 5lf7K-5touD:
undetectable
5lf7L-5touD:
undetectable		 5lf7K-5touD:
26.07
5lf7L-5touD:
19.09
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.
5tou PHYCOCYANIN BETA-1
SUBUNIT

(Pseudanabaena
sp. lw0831) 		no annotation 5 ALA D 169
VAL D  93
GLY D 130
GLY D 132
ASP D 165
 None
 0.88A 5lf7K-5touD:
undetectable
5lf7L-5touD:
undetectable		 5lf7K-5touD:
26.07
5lf7L-5touD:
19.09
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.
5uz9 CRISPR-ASSOCIATED
PROTEIN CSY3

(Pseudomonas
aeruginosa) 		PF09615
(Cas_Csy3) 		6 ALA C  46
THR C 109
ALA C  48
VAL C  61
GLY C 241
ASP C 106
 None
 1.47A 5lf7K-5uz9C:
undetectable
5lf7L-5uz9C:
undetectable		 5lf7K-5uz9C:
22.32
5lf7L-5uz9C:
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.
5vfr PROTEASOME SUBUNIT
BETA TYPE-5

(Homo sapiens) 		no annotation 9 THR R   1
ALA R  20
THR R  21
ALA R  22
VAL R  31
LYS R  33
GLY R  47
GLY R  48
ALA R  49
 None
 0.76A 5lf7K-5vfrR:
34.3
5lf7L-5vfrR:
24.6		 5lf7K-5vfrR:
undetectable
5lf7L-5vfrR:
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.
5xnz CRED

(Streptomyces
cremeus) 		no annotation 6 ALA A 254
THR A 253
VAL A 308
GLY A 345
GLY A 346
ALA A 347
 None
 1.42A 5lf7K-5xnzA:
undetectable
5lf7L-5xnzA:
undetectable		 5lf7K-5xnzA:
undetectable
5lf7L-5xnzA:
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.
5ykd D-HYDANTOINASE/DIHYD
ROPYRIMIDINASE

(Pseudomonas
aeruginosa) 		no annotation 5 ALA A  80
THR A  79
GLY A  86
GLY A  85
ALA A  84
 None
 0.92A 5lf7K-5ykdA:
undetectable
5lf7L-5ykdA:
undetectable		 5lf7K-5ykdA:
undetectable
5lf7L-5ykdA:
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.
6avo PROTEASOME SUBUNIT
BETA TYPE-10

(Homo sapiens) 		no annotation 6 THR B   1
ALA B  20
THR B  21
LYS B  33
GLY B  47
ALA B  49
 None
 0.69A 5lf7K-6avoB:
21.8
5lf7L-6avoB:
20.0		 5lf7K-6avoB:
undetectable
5lf7L-6avoB:
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.
6avo PROTEASOME SUBUNIT
BETA TYPE-10

(Homo sapiens) 		no annotation 6 THR B 193
THR B 160
ALA B 161
GLY B 171
GLY B 170
ASP B 166
 None
 1.47A 5lf7K-6avoB:
21.8
5lf7L-6avoB:
20.0		 5lf7K-6avoB:
undetectable
5lf7L-6avoB:
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.
6avo PROTEASOME SUBUNIT
BETA TYPE-8

(Homo sapiens) 		no annotation 6 ALA C  20
ALA C  22
VAL C  31
LYS C  33
MET C  45
GLY C  47
 BZ7  C 301 (-3.5A)
BZ7  C 301 (-3.5A)
BZ7  C 301 (-3.5A)
BZ7  C 301 ( 4.8A)
BZ7  C 301 ( 4.7A)
BZ7  C 301 (-4.5A)
 1.10A 5lf7K-6avoC:
35.4
5lf7L-6avoC:
25.9		 5lf7K-6avoC:
undetectable
5lf7L-6avoC:
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.
6avo PROTEASOME SUBUNIT
BETA TYPE-8

(Homo sapiens) 		no annotation 8 THR C   1
ALA C  20
ALA C  22
VAL C  31
LYS C  33
MET C  45
GLY C  47
ALA C  49
 BZ7  C 301 (-4.0A)
BZ7  C 301 (-3.5A)
BZ7  C 301 (-3.5A)
BZ7  C 301 (-3.5A)
BZ7  C 301 ( 4.8A)
BZ7  C 301 ( 4.7A)
BZ7  C 301 (-4.5A)
BZ7  C 301 (-2.8A)
 0.68A 5lf7K-6avoC:
35.4
5lf7L-6avoC:
25.9		 5lf7K-6avoC:
undetectable
5lf7L-6avoC:
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.
6avo PROTEASOME SUBUNIT
BETA TYPE-9

(Homo sapiens) 		no annotation 5 THR A   1
ALA A  22
LYS A  33
GLY A  47
ALA A  49
 None
 0.57A 5lf7K-6avoA:
25.6
5lf7L-6avoA:
27.1		 5lf7K-6avoA:
undetectable
5lf7L-6avoA:
undetectable