SIMILAR PATTERNS OF AMINO ACIDS FOR 1S8F_A_BEZA1501

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c4x PROTEIN
(2-HYDROXY-6-OXO-6-P
HENYLHEXA-2,4-DIENOA
TE HYDROLASE)

(Rhodococcus
jostii) 		PF12697
(Abhydrolase_6) 		4 ILE A 166
TRP A 264
LEU A 165
PRO A  39
 None
 1.48A 1s8fA-1c4xA:
2.1
1s8fB-1c4xA:
4.0		 1s8fA-1c4xA:
22.53
1s8fB-1c4xA:
22.53
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.
1d2e ELONGATION FACTOR TU
(EF-TU)

(Bos taurus) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		4 ILE A 415
ARG A 281
LEU A 381
PRO A 261
 None
 1.50A 1s8fA-1d2eA:
15.7
1s8fB-1d2eA:
15.2		 1s8fA-1d2eA:
17.05
1s8fB-1d2eA:
17.05
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.
1kik PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE LCK

(Homo sapiens) 		PF00018
(SH3_1) 		4 ILE A 111
TRP A  97
LEU A  80
PRO A  74
 None
 1.48A 1s8fA-1kikA:
undetectable
1s8fB-1kikA:
undetectable		 1s8fA-1kikA:
16.38
1s8fB-1kikA:
16.38
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.
1nxk MAP KINASE-ACTIVATED
PROTEIN KINASE 2

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 302
TRP A 291
LEU A 306
PRO A 262
 None
 1.35A 1s8fA-1nxkA:
0.1
1s8fB-1nxkA:
0.0		 1s8fA-1nxkA:
19.90
1s8fB-1nxkA:
19.90
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.
1t8w AMP NUCLEOSIDASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1)
PF10423
(AMNp_N) 		4 ILE A 273
ARG A 464
TRP A 216
LEU A 202
 None
 1.30A 1s8fA-1t8wA:
3.4
1s8fB-1t8wA:
4.3		 1s8fA-1t8wA:
18.45
1s8fB-1t8wA:
18.45
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.
1vkz PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE

(Thermotoga
maritima) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		4 ILE A 344
ARG A  40
LEU A 383
PRO A 339
 None
 1.43A 1s8fA-1vkzA:
1.1
1s8fB-1vkzA:
0.3		 1s8fA-1vkzA:
15.55
1s8fB-1vkzA:
15.55
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.
2ac5 MAP
KINASE-INTERACTING
SERINE/THREONINE
KINASE 2

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 345
TRP A 334
LEU A 349
PRO A 294
 None
 1.17A 1s8fA-2ac5A:
0.0
1s8fB-2ac5A:
0.0		 1s8fA-2ac5A:
18.61
1s8fB-2ac5A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bdw HYPOTHETICAL PROTEIN
K11E8.1D

(Caenorhabditis
elegans) 		PF00069
(Pkinase) 		4 ILE A 248
TRP A 237
LEU A 252
PRO A 212
 None
 1.18A 1s8fA-2bdwA:
undetectable
1s8fB-2bdwA:
0.0		 1s8fA-2bdwA:
20.97
1s8fB-2bdwA:
20.97
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.
2bll PROTEIN YFBG

(Escherichia
coli) 		PF01370
(Epimerase) 		4 ILE A 327
TRP A 493
LEU A 389
PRO A 430
 None
 1.44A 1s8fA-2bllA:
1.4
1s8fB-2bllA:
4.1		 1s8fA-2bllA:
18.26
1s8fB-2bllA:
18.26
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.
2fw5 DHC, DIHEME
CYTOCHROME C

(Rhodobacter
sphaeroides) 		PF09626
(DHC) 		4 ILE A  96
TRP A  41
LEU A  99
PRO A  93
 HEM  A 805 (-3.9A)
None
None
None
 1.39A 1s8fA-2fw5A:
undetectable
1s8fB-2fw5A:
undetectable		 1s8fA-2fw5A:
18.23
1s8fB-2fw5A:
18.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gj4 GLYCOGEN
PHOSPHORYLASE,
MUSCLE FORM

(Oryctolagus
cuniculus) 		PF00343
(Phosphorylase) 		4 ILE A 817
TRP A 825
LEU A 150
PRO A 829
 None
 1.46A 1s8fA-2gj4A:
7.1
1s8fB-2gj4A:
7.1		 1s8fA-2gj4A:
13.26
1s8fB-2gj4A:
13.26
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.
2hw6 MAP
KINASE-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 310
TRP A 299
LEU A 314
PRO A 259
 None
 1.20A 1s8fA-2hw6A:
undetectable
1s8fB-2hw6A:
undetectable		 1s8fA-2hw6A:
20.90
1s8fB-2hw6A:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jam CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1G

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 255
TRP A 244
LEU A 259
PRO A 219
 None
 1.31A 1s8fA-2jamA:
undetectable
1s8fB-2jamA:
undetectable		 1s8fA-2jamA:
20.50
1s8fB-2jamA:
20.50
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.
2khv PHAGE INTEGRASE

(Nitrosospira
multiformis) 		no annotation 4 ILE A  74
TRP A  95
LEU A  78
PRO A  92
 None
 1.35A 1s8fA-2khvA:
undetectable
1s8fB-2khvA:
undetectable		 1s8fA-2khvA:
18.23
1s8fB-2khvA:
18.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2poz PUTATIVE DEHYDRATASE

(Mesorhizobium
japonicum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ILE A 325
ARG A 121
LEU A 321
PRO A 306
 None
 1.50A 1s8fA-2pozA:
2.7
1s8fB-2pozA:
undetectable		 1s8fA-2pozA:
21.07
1s8fB-2pozA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qe8 UNCHARACTERIZED
PROTEIN

(Trichormus
variabilis) 		PF03022
(MRJP) 		4 ILE A 147
ARG A 158
LEU A 110
PRO A  92
 None
 1.49A 1s8fA-2qe8A:
undetectable
1s8fB-2qe8A:
undetectable		 1s8fA-2qe8A:
18.88
1s8fB-2qe8A:
18.88
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.
2y7j PHOSPHORYLASE B
KINASE GAMMA
CATALYTIC CHAIN,
TESTIS/LIVER ISOFORM

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 268
TRP A 257
LEU A 272
PRO A 232
 None
 1.25A 1s8fA-2y7jA:
undetectable
1s8fB-2y7jA:
undetectable		 1s8fA-2y7jA:
15.80
1s8fB-2y7jA:
15.80
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.
3bhh CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE II BETA
CHAIN

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 249
TRP A 238
LEU A 253
PRO A 213
 None
 1.24A 1s8fA-3bhhA:
undetectable
1s8fB-3bhhA:
undetectable		 1s8fA-3bhhA:
19.93
1s8fB-3bhhA:
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.
3dfa CALCIUM-DEPENDENT
PROTEIN KINASE
CGD3_920

(Cryptosporidium
parvum) 		PF00069
(Pkinase) 		4 ILE A 240
TRP A 229
LEU A 244
PRO A 204
 None
 1.20A 1s8fA-3dfaA:
undetectable
1s8fB-3dfaA:
undetectable		 1s8fA-3dfaA:
25.61
1s8fB-3dfaA:
25.61
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.
3f3z CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE WITH A KINASE
DOMAIN AND 4
CALMODULIN LIKE EF
HANDS

(Cryptosporidium
parvum) 		PF00069
(Pkinase) 		4 ILE A 259
TRP A 248
LEU A 263
PRO A 223
 None
 1.24A 1s8fA-3f3zA:
undetectable
1s8fB-3f3zA:
undetectable		 1s8fA-3f3zA:
19.46
1s8fB-3f3zA:
19.46
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.
3igo CALMODULIN-DOMAIN
PROTEIN KINASE 1

(Cryptosporidium
parvum) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 ILE A 309
TRP A 298
LEU A 313
PRO A 273
 None
 1.21A 1s8fA-3igoA:
undetectable
1s8fB-3igoA:
undetectable		 1s8fA-3igoA:
16.90
1s8fB-3igoA:
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.
3k0s DNA MISMATCH REPAIR
PROTEIN MUTS

(Escherichia
coli) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		4 ILE A 279
ARG A 274
LEU A 632
PRO A 314
 None
 1.22A 1s8fA-3k0sA:
undetectable
1s8fB-3k0sA:
undetectable		 1s8fA-3k0sA:
13.39
1s8fB-3k0sA:
13.39
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.
3k8p PROTEIN TRANSPORT
PROTEIN SEC39

(Saccharomyces
cerevisiae) 		PF08314
(Sec39) 		4 ILE D 197
ARG D 175
TRP D 185
LEU D 218
 None
 1.25A 1s8fA-3k8pD:
undetectable
1s8fB-3k8pD:
undetectable		 1s8fA-3k8pD:
12.34
1s8fB-3k8pD:
12.34
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.
3kn5 RIBOSOMAL PROTEIN S6
KINASE ALPHA-5

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 664
TRP A 653
LEU A 668
PRO A 621
 None
 1.17A 1s8fA-3kn5A:
undetectable
1s8fB-3kn5A:
undetectable		 1s8fA-3kn5A:
20.49
1s8fB-3kn5A:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lij CALCIUM/CALMODULIN
DEPENDENT PROTEIN
KINASE WITH A KINASE
DOMAIN AND 4
CALMODULIN LIKE EF
HANDS

(Cryptosporidium
parvum) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 ILE A 295
TRP A 284
LEU A 299
PRO A 259
 None
 1.22A 1s8fA-3lijA:
undetectable
1s8fB-3lijA:
undetectable		 1s8fA-3lijA:
17.43
1s8fB-3lijA:
17.43
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.
3ma6 CALMODULIN-DOMAIN
PROTEIN KINASE 1

(Toxoplasma
gondii) 		PF00069
(Pkinase) 		4 ILE A 268
TRP A 257
LEU A 272
PRO A 232
 None
 1.25A 1s8fA-3ma6A:
undetectable
1s8fB-3ma6A:
undetectable		 1s8fA-3ma6A:
20.00
1s8fB-3ma6A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q4d MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY
POSSIBLE
CHLOROMUCONATE
CYCLOISOMERASE

(Cytophaga
hutchinsonii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ILE A 212
ARG A 178
LEU A 207
PRO A 209
 None
 1.41A 1s8fA-3q4dA:
undetectable
1s8fB-3q4dA:
undetectable		 1s8fA-3q4dA:
18.73
1s8fB-3q4dA:
18.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q5i PROTEIN KINASE

(Plasmodium
berghei) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 ILE A 301
TRP A 290
LEU A 305
PRO A 265
 None
 1.24A 1s8fA-3q5iA:
undetectable
1s8fB-3q5iA:
undetectable		 1s8fA-3q5iA:
16.50
1s8fB-3q5iA:
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.
3q9n COA BINDING PROTEIN

(Escherichia
coli) 		PF13380
(CoA_binding_2) 		4 ILE A  12
ARG A 136
TRP A 103
PRO A   3
 None
 1.48A 1s8fA-3q9nA:
undetectable
1s8fB-3q9nA:
2.2		 1s8fA-3q9nA:
20.94
1s8fB-3q9nA:
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.
3rim TRANSKETOLASE

(Mycobacterium
tuberculosis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ILE A 536
ARG A 458
TRP A 623
LEU A 548
 None
 1.43A 1s8fA-3rimA:
2.2
1s8fB-3rimA:
2.2		 1s8fA-3rimA:
14.11
1s8fB-3rimA:
14.11
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.
3rl3 METALLOPHOSPHOESTERA
SE MPPED2

(Rattus
norvegicus) 		PF00149
(Metallophos) 		4 ILE A 203
ARG A 242
LEU A 210
PRO A 245
 None
 1.44A 1s8fA-3rl3A:
undetectable
1s8fB-3rl3A:
undetectable		 1s8fA-3rl3A:
22.70
1s8fB-3rl3A:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3she MAP KINASE-ACTIVATED
PROTEIN KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 281
TRP A 270
LEU A 285
PRO A 241
 None
 1.22A 1s8fA-3sheA:
undetectable
1s8fB-3sheA:
undetectable		 1s8fA-3sheA:
22.01
1s8fB-3sheA:
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.
3slg PBGP3 PROTEIN

(Burkholderia
pseudomallei) 		PF01370
(Epimerase) 		4 ILE A  15
TRP A 180
LEU A  77
PRO A 118
 None
 1.48A 1s8fA-3slgA:
4.5
1s8fB-3slgA:
4.1		 1s8fA-3slgA:
18.87
1s8fB-3slgA:
18.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sxf CALMODULIN-DOMAIN
PROTEIN KINASE 1

(Toxoplasma
gondii) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 ILE A 285
TRP A 274
LEU A 289
PRO A 249
 None
 1.24A 1s8fA-3sxfA:
undetectable
1s8fB-3sxfA:
undetectable		 1s8fA-3sxfA:
18.06
1s8fB-3sxfA:
18.06
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.
3t79 KLLA0E03807P

(Kluyveromyces
lactis) 		PF16787
(NDC10_II) 		4 ILE A 109
TRP A 268
LEU A 261
PRO A 262
 None
 1.39A 1s8fA-3t79A:
undetectable
1s8fB-3t79A:
undetectable		 1s8fA-3t79A:
18.09
1s8fB-3t79A:
18.09
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.
3vqr PUTATIVE
OXIDOREDUCTASE

(Aeropyrum
pernix) 		PF01266
(DAO) 		4 ILE A 117
ARG A 125
LEU A  89
PRO A 280
 None
 1.17A 1s8fA-3vqrA:
undetectable
1s8fB-3vqrA:
1.8		 1s8fA-3vqrA:
18.83
1s8fB-3vqrA:
18.83
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.
3vth HYDROGENASE
MATURATION FACTOR

(Caldanaerobacter
subterraneus) 		PF00708
(Acylphosphatase)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		4 ILE A 205
ARG A 130
LEU A 193
PRO A 132
 None
 1.43A 1s8fA-3vthA:
undetectable
1s8fB-3vthA:
undetectable		 1s8fA-3vthA:
12.92
1s8fB-3vthA:
12.92
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.
4fwb HALOALKANE
DEHALOGENASE

(Rhodococcus
rhodochrous) 		PF00561
(Abhydrolase_1) 		4 ILE A  62
ARG A  30
LEU A  97
PRO A  34
 None
 1.43A 1s8fA-4fwbA:
4.1
1s8fB-4fwbA:
3.7		 1s8fA-4fwbA:
18.67
1s8fB-4fwbA:
18.67
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.
4gs1 DYP-TYPE PEROXIDASE

(Thermobifida
cellulosilytica) 		PF04261
(Dyp_perox) 		4 ILE A 144
TRP A 268
LEU A 110
PRO A 421
 None
 1.27A 1s8fA-4gs1A:
undetectable
1s8fB-4gs1A:
undetectable		 1s8fA-4gs1A:
17.75
1s8fB-4gs1A:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hu3 OXYGEN SENSOR
PROTEIN DOSP

(Escherichia
coli) 		PF00563
(EAL) 		4 ILE A 575
TRP A 622
LEU A 572
PRO A 630
 None
 1.25A 1s8fA-4hu3A:
undetectable
1s8fB-4hu3A:
undetectable		 1s8fA-4hu3A:
19.29
1s8fB-4hu3A:
19.29
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.
4mvf CALCIUM-DEPENDENT
PROTEIN KINASE 2

(Plasmodium
falciparum) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 ILE A 303
TRP A 292
LEU A 307
PRO A 267
 None
 1.23A 1s8fA-4mvfA:
undetectable
1s8fB-4mvfA:
undetectable		 1s8fA-4mvfA:
17.34
1s8fB-4mvfA:
17.34
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.
4uop LIPOTEICHOIC ACID
PRIMASE

(Listeria
monocytogenes) 		PF00884
(Sulfatase) 		4 ILE A 307
ARG A 312
LEU A 606
PRO A 607
 None
 1.23A 1s8fA-4uopA:
undetectable
1s8fB-4uopA:
undetectable		 1s8fA-4uopA:
20.28
1s8fB-4uopA:
20.28
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.
4ysj CALMODULIN-LIKE
DOMAIN PROTEIN
KINASE

(Eimeria tenella) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 ILE A 262
TRP A 251
LEU A 266
PRO A 226
 None
 1.24A 1s8fA-4ysjA:
undetectable
1s8fB-4ysjA:
undetectable		 1s8fA-4ysjA:
17.96
1s8fB-4ysjA:
17.96
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.
5eef HDAC6

(Danio rerio) 		PF00850
(Hist_deacetyl) 		4 ILE A 401
TRP A 286
LEU A 398
PRO A 393
 None
 1.15A 1s8fA-5eefA:
undetectable
1s8fB-5eefA:
undetectable		 1s8fA-5eefA:
18.53
1s8fB-5eefA:
18.53
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.
5f75 THIOCYANATE
DEHYDROGENASE

(Thioalkalivibrio
paradoxus) 		no annotation 4 ILE A 209
ARG A 231
LEU A 540
PRO A 534
 None
 1.44A 1s8fA-5f75A:
undetectable
1s8fB-5f75A:
undetectable		 1s8fA-5f75A:
16.06
1s8fB-5f75A:
16.06
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.
5fjn L-AMINO ACID
DEAMINASE

(Cosenzaea
myxofaciens) 		PF01266
(DAO) 		4 ILE A 421
ARG A 471
LEU A 272
PRO A 273
 None
 1.28A 1s8fA-5fjnA:
undetectable
1s8fB-5fjnA:
undetectable		 1s8fA-5fjnA:
18.89
1s8fB-5fjnA:
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.
5fqd DNA DAMAGE-BINDING
PROTEIN 1

(Homo sapiens) 		PF03178
(CPSF_A)
PF10433
(MMS1_N) 		4 ILE A  88
ARG A 103
LEU A 145
PRO A  69
 None
 1.43A 1s8fA-5fqdA:
undetectable
1s8fB-5fqdA:
undetectable		 1s8fA-5fqdA:
12.05
1s8fB-5fqdA:
12.05
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.
5hu3 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE II ALPHA
CHAIN

(Drosophila
melanogaster) 		PF00069
(Pkinase) 		4 ILE A 249
TRP A 238
LEU A 253
PRO A 213
 None
 1.25A 1s8fA-5hu3A:
undetectable
1s8fB-5hu3A:
undetectable		 1s8fA-5hu3A:
22.07
1s8fB-5hu3A:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ig1 CAMK/CAMK2 PROTEIN
KINASE

(Salpingoeca
rosetta) 		PF00069
(Pkinase) 		4 ILE A 252
TRP A 241
LEU A 256
PRO A 216
 None
 1.22A 1s8fA-5ig1A:
undetectable
1s8fB-5ig1A:
undetectable		 1s8fA-5ig1A:
21.21
1s8fB-5ig1A:
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.
5jzn SERINE/THREONINE-PRO
TEIN KINASE DCLK1

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 624
TRP A 613
LEU A 628
PRO A 586
 None
 1.26A 1s8fA-5jznA:
undetectable
1s8fB-5jznA:
undetectable		 1s8fA-5jznA:
21.91
1s8fB-5jznA:
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.
5m59 PRE-MRNA SPLICING
HELICASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		4 ILE A 569
TRP A 518
LEU A 607
PRO A 522
 None
 1.42A 1s8fA-5m59A:
undetectable
1s8fB-5m59A:
undetectable		 1s8fA-5m59A:
6.89
1s8fB-5m59A:
6.89
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.
5nfq EPOXIDE HYDROLASE
BELONGING TO
ALPHA/BETA HYDROLASE
SUPERFAMILY
METAGENOMIC FROM
TOMSK SAMPLE

(metagenome) 		no annotation 4 ILE A 214
ARG A 155
LEU A 138
PRO A 217
 PGE  A 412 (-4.6A)
None
None
None
 1.46A 1s8fA-5nfqA:
2.9
1s8fB-5nfqA:
2.8		 1s8fA-5nfqA:
undetectable
1s8fB-5nfqA:
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.
5td8 KINETOCHORE PROTEIN
SPC25

(Saccharomyces
cerevisiae) 		no annotation 4 ILE D 171
ARG D 193
LEU D 217
PRO D 186
 None
None
HG  D 301 (-3.0A)
None
 1.34A 1s8fA-5td8D:
undetectable
1s8fB-5td8D:
undetectable		 1s8fA-5td8D:
20.90
1s8fB-5td8D:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yx9 SHORT TRANSIENT
RECEPTOR POTENTIAL
CHANNEL 6

(Homo sapiens) 		no annotation 4 ILE A 345
ARG A 365
LEU A 332
PRO A 293
 None
 1.39A 1s8fA-5yx9A:
undetectable
1s8fB-5yx9A:
undetectable		 1s8fA-5yx9A:
undetectable
1s8fB-5yx9A:
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.
6fkh ATP SYNTHASE SUBUNIT
ALPHA, CHLOROPLASTIC

(Spinacia
oleracea) 		no annotation 4 ILE C 130
ARG C 301
LEU C 238
PRO C 240
 None
 1.32A 1s8fA-6fkhC:
undetectable
1s8fB-6fkhC:
undetectable		 1s8fA-6fkhC:
undetectable
1s8fB-6fkhC:
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.
6gc6 50S RIBOSOMAL
PROTEIN L2

(Escherichia
coli) 		no annotation 4 ILE C 115
ARG C  68
LEU C 109
PRO C 106
 None
 1.48A 1s8fA-6gc6C:
undetectable
1s8fB-6gc6C:
undetectable		 1s8fA-6gc6C:
undetectable
1s8fB-6gc6C:
undetectable