SIMILAR PATTERNS OF AMINO ACIDS FOR 3B0W_B_DGXB1_2

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1atj PEROXIDASE C1A

(Armoracia
rusticana) 		PF00141
(peroxidase) 		3 LEU A  54
VAL A  95
ARG A 298
 None
 0.81A 3b0wB-1atjA:
0.0		 3b0wB-1atjA:
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.
1bgp BARLEY GRAIN
PEROXIDASE

(Hordeum vulgare) 		PF00141
(peroxidase) 		3 LEU A  61
VAL A 104
ARG A 298
 None
 0.89A 3b0wB-1bgpA:
0.2		 3b0wB-1bgpA:
24.49
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.
1bu8 PROTEIN (PANCREATIC
LIPASE RELATED
PROTEIN 2)

(Rattus
norvegicus) 		PF00151
(Lipase)
PF01477
(PLAT) 		3 LEU A   8
VAL A 157
ARG A 164
 None
 0.60A 3b0wB-1bu8A:
0.0		 3b0wB-1bu8A:
19.12
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.
1ekz MATERNAL EFFECT
PROTEIN (STAUFEN)

(Drosophila
melanogaster) 		PF00035
(dsrm) 		3 LEU A  76
VAL A  13
ARG A  20
 None
 0.78A 3b0wB-1ekzA:
undetectable		 3b0wB-1ekzA:
10.93
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.
1gk2 HISTIDINE
AMMONIA-LYASE

(Pseudomonas
putida) 		PF00221
(Lyase_aromatic) 		3 LEU A 185
VAL A  42
ARG A 115
 None
 0.90A 3b0wB-1gk2A:
0.0		 3b0wB-1gk2A:
20.12
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.
1i9g HYPOTHETICAL PROTEIN
RV2118C

(Mycobacterium
tuberculosis) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		3 LEU A 167
VAL A 185
ARG A 191
 None
 0.81A 3b0wB-1i9gA:
0.0		 3b0wB-1i9gA:
24.83
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.
1icp 12-OXOPHYTODIENOATE
REDUCTASE 1

(Solanum
lycopersicum) 		PF00724
(Oxidored_FMN) 		3 LEU A 157
VAL A 202
ARG A 205
 None
None
CL  A 505 (-3.9A)
 0.38A 3b0wB-1icpA:
0.0		 3b0wB-1icpA:
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.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 LEU A 786
VAL A 777
ARG A 766
 None
 0.87A 3b0wB-1kcwA:
0.0		 3b0wB-1kcwA:
12.22
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.
1mq7 DEOXYURIDINE
5'-TRIPHOSPHATE
NUCLEOTIDOHYDROLASE

(Mycobacterium
tuberculosis) 		PF00692
(dUTPase) 		3 LEU A  10
VAL A  92
ARG A  46
 None
 0.90A 3b0wB-1mq7A:
0.0		 3b0wB-1mq7A:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mzv ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Leishmania
tarentolae) 		PF00156
(Pribosyltran) 		3 LEU A 209
VAL A  39
ARG A  41
 None
 0.83A 3b0wB-1mzvA:
undetectable		 3b0wB-1mzvA:
22.93
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.
1p43 ENOLASE 1

(Saccharomyces
cerevisiae) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 LEU A 436
VAL A 387
ARG A 391
 None
 0.86A 3b0wB-1p43A:
undetectable		 3b0wB-1p43A:
19.22
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.
1qcd ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Leishmania
donovani) 		PF00156
(Pribosyltran) 		3 LEU A 209
VAL A  39
ARG A  41
 None
 0.87A 3b0wB-1qcdA:
undetectable		 3b0wB-1qcdA:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wao SERINE/THREONINE
PROTEIN PHOSPHATASE
5

(Homo sapiens) 		PF00149
(Metallophos)
PF00515
(TPR_1)
PF08321
(PPP5) 		3 LEU 1 223
VAL 1 334
ARG 1 371
 None
 0.56A 3b0wB-1wao1:
undetectable		 3b0wB-1wao1:
19.83
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.
2ass S-PHASE
KINASE-ASSOCIATED
PROTEIN 2

(Homo sapiens) 		PF12937
(F-box-like) 		3 LEU B2100
VAL B2123
ARG B2126
 None
 0.78A 3b0wB-2assB:
undetectable		 3b0wB-2assB:
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.
2b3b GLUCOSE-BINDING
PROTEIN

(Thermus
thermophilus) 		PF01547
(SBP_bac_1) 		3 LEU A  55
VAL A  77
ARG A  80
 None
 0.82A 3b0wB-2b3bA:
undetectable		 3b0wB-2b3bA:
21.59
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.
2bws XAA-PRO
AMINOPEPTIDASE P

(Escherichia
coli) 		PF00557
(Peptidase_M24)
PF05195
(AMP_N) 		3 LEU A 102
VAL A  63
ARG A  12
 None
 0.73A 3b0wB-2bwsA:
undetectable		 3b0wB-2bwsA:
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.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		3 LEU A 691
VAL A 537
ARG A 740
 None
 0.90A 3b0wB-2c4mA:
undetectable		 3b0wB-2c4mA:
14.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ef0 ORNITHINE
CARBAMOYLTRANSFERASE

(Thermus
thermophilus) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		3 LEU A 212
VAL A 160
ARG A 182
 None
 0.80A 3b0wB-2ef0A:
undetectable		 3b0wB-2ef0A:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fd5 TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		PF00440
(TetR_N) 		3 LEU A  63
VAL A 132
ARG A  67
 None
 0.90A 3b0wB-2fd5A:
undetectable		 3b0wB-2fd5A:
21.46
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.
2gdq YITF

(Bacillus
subtilis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 LEU A 260
VAL A 237
ARG A 232
 None
 0.85A 3b0wB-2gdqA:
undetectable		 3b0wB-2gdqA:
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.
2go7 HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY

(Streptococcus
pneumoniae) 		PF13419
(HAD_2) 		3 LEU A 120
VAL A  92
ARG A  90
 None
 0.84A 3b0wB-2go7A:
undetectable		 3b0wB-2go7A:
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.
2hoq PUTATIVE
HAD-HYDROLASE PH1655

(Pyrococcus
horikoshii) 		PF13419
(HAD_2) 		3 LEU A 131
VAL A 102
ARG A 100
 None
 0.85A 3b0wB-2hoqA:
undetectable		 3b0wB-2hoqA:
22.48
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.
2jy6 UBIQUILIN-1

(Homo sapiens) 		PF00627
(UBA) 		3 LEU B 554
VAL B 545
ARG B 562
 None
 0.81A 3b0wB-2jy6B:
undetectable		 3b0wB-2jy6B:
10.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oga TRANSAMINASE

(Streptomyces
venezuelae) 		PF01041
(DegT_DnrJ_EryC1) 		3 LEU A  41
VAL A  33
ARG A  38
 None
 0.68A 3b0wB-2ogaA:
undetectable		 3b0wB-2ogaA:
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.
2pag HYPOTHETICAL PROTEIN

(Pseudomonas
syringae group
genomosp. 3) 		PF14567
(SUKH_5) 		3 LEU A  34
VAL A  83
ARG A  85
 None
 0.75A 3b0wB-2pagA:
undetectable		 3b0wB-2pagA:
19.84
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.
2q3r 12-OXOPHYTODIENOATE
REDUCTASE 1

(Arabidopsis
thaliana) 		PF00724
(Oxidored_FMN) 		3 LEU A 153
VAL A 198
ARG A 201
 None
 0.60A 3b0wB-2q3rA:
undetectable		 3b0wB-2q3rA:
22.11
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.
2q9g CYTOCHROME P450 46A1

(Homo sapiens) 		PF00067
(p450) 		3 LEU A 120
VAL A 253
ARG A 251
 None
 0.84A 3b0wB-2q9gA:
undetectable		 3b0wB-2q9gA:
20.78
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.
2qtv SMALL COPII COAT
GTPASE SAR1

(Saccharomyces
cerevisiae) 		PF00025
(Arf) 		3 LEU B 122
VAL B 128
ARG B 164
 None
 0.89A 3b0wB-2qtvB:
undetectable		 3b0wB-2qtvB:
21.46
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.
2vac TWINFILIN-2

(Homo sapiens) 		PF00241
(Cofilin_ADF) 		3 LEU A  73
VAL A  57
ARG A  26
 None
 0.83A 3b0wB-2vacA:
undetectable		 3b0wB-2vacA:
17.21
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.
2w6l COBE

(Pseudomonas
aeruginosa) 		PF01890
(CbiG_C) 		3 LEU A  39
VAL A  68
ARG A  66
 None
 0.81A 3b0wB-2w6lA:
undetectable		 3b0wB-2w6lA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x24 ACETYL-COA
CARBOXYLASE

(Bos taurus) 		PF01039
(Carboxyl_trans) 		3 LEU A 659
VAL A 706
ARG A 656
 None
 0.87A 3b0wB-2x24A:
undetectable		 3b0wB-2x24A:
15.61
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.
2xa0 APOPTOSIS REGULATOR
BCL-2

(Homo sapiens) 		PF00452
(Bcl-2)
PF02180
(BH4) 		3 LEU A 119
VAL A 162
ARG A 164
 None
 0.83A 3b0wB-2xa0A:
undetectable		 3b0wB-2xa0A:
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.
2y4r 4-AMINO-4-DEOXYCHORI
SMATE LYASE

(Pseudomonas
aeruginosa) 		PF01063
(Aminotran_4) 		3 LEU A 183
VAL A 171
ARG A 219
 None
 0.90A 3b0wB-2y4rA:
undetectable		 3b0wB-2y4rA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yr0 HYPOTHETICAL PROTEIN
TTHA0223

(Thermus
thermophilus) 		PF08241
(Methyltransf_11) 		3 LEU A 100
VAL A 123
ARG A 129
 None
 0.73A 3b0wB-2yr0A:
undetectable		 3b0wB-2yr0A:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a8u OMEGA-AMINO
ACID--PYRUVATE
AMINOTRANSFERASE

(Pseudomonas
putida) 		PF00202
(Aminotran_3) 		3 LEU X  56
VAL X 261
ARG X 267
 None
PLP  X 450 (-4.2A)
None
 0.85A 3b0wB-3a8uX:
undetectable		 3b0wB-3a8uX:
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.
3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE

(Bifidobacterium
longum) 		PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N) 		3 LEU A 690
VAL A 716
ARG A 723
 None
 0.70A 3b0wB-3ai7A:
undetectable		 3b0wB-3ai7A:
13.77
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.
3bkw S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE

(Mesorhizobium
japonicum) 		PF08241
(Methyltransf_11) 		3 LEU A 116
VAL A 193
ARG A 191
 None
None
EDO  A 243 ( 3.8A)
 0.74A 3b0wB-3bkwA:
undetectable		 3b0wB-3bkwA:
24.39
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.
3c8v PUTATIVE
ACETYLTRANSFERASE

(Desulfovibrio
alaskensis) 		no annotation 3 LEU A 204
VAL A 401
ARG A 409
 None
None
EDO  A 485 (-4.0A)
 0.81A 3b0wB-3c8vA:
undetectable		 3b0wB-3c8vA:
15.87
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.
3ci0 PSEUDOPILIN GSPK

(Escherichia
coli) 		PF03934
(T2SSK) 		3 LEU K 211
VAL K  65
ARG K 239
 None
 0.67A 3b0wB-3ci0K:
undetectable		 3b0wB-3ci0K:
20.06
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.
3da1 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Bacillus
halodurans) 		PF01266
(DAO)
PF16901
(DAO_C) 		3 LEU A 325
VAL A 332
ARG A 261
 None
 0.89A 3b0wB-3da1A:
undetectable		 3b0wB-3da1A:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fj4 MUCONATE
CYCLOISOMERASE

(Pseudomonas
protegens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 LEU A 321
VAL A 354
ARG A 135
 None
 0.74A 3b0wB-3fj4A:
undetectable		 3b0wB-3fj4A:
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.
3g5s METHYLENETETRAHYDROF
OLATE--TRNA-(URACIL-
5-)-METHYLTRANSFERAS
E TRMFO

(Thermus
thermophilus) 		PF01134
(GIDA) 		3 LEU A 113
VAL A   6
ARG A   3
 None
 0.72A 3b0wB-3g5sA:
undetectable		 3b0wB-3g5sA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h68 SERINE/THREONINE-PRO
TEIN PHOSPHATASE 5

(Homo sapiens) 		PF00149
(Metallophos)
PF08321
(PPP5) 		3 LEU A 223
VAL A 334
ARG A 371
 None
 0.73A 3b0wB-3h68A:
undetectable		 3b0wB-3h68A:
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.
3ib7 ICC PROTEIN

(Mycobacterium
tuberculosis) 		PF00149
(Metallophos) 		3 LEU A 109
VAL A  80
ARG A  77
 MPD  A 779 ( 4.7A)
None
None
 0.80A 3b0wB-3ib7A:
undetectable		 3b0wB-3ib7A:
21.32
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.
3io0 ETUB PROTEIN

(Clostridium
kluyveri) 		PF00936
(BMC) 		3 LEU A 278
VAL A 188
ARG A 282
 None
 0.73A 3b0wB-3io0A:
undetectable		 3b0wB-3io0A:
24.44
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.
3j9f POLIOVIRUS RECEPTOR

(Homo sapiens) 		PF07686
(V-set) 		3 LEU 7 103
VAL 7  31
ARG 7 104
 None
 0.75A 3b0wB-3j9f7:
undetectable		 3b0wB-3j9f7:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jvv TWITCHING MOBILITY
PROTEIN

(Pseudomonas
aeruginosa) 		PF00437
(T2SSE) 		3 LEU A 311
VAL A 121
ARG A 117
 None
 0.86A 3b0wB-3jvvA:
undetectable		 3b0wB-3jvvA:
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.
3ksw STEROL 14-ALPHA
DEMETHYLASE

(Trypanosoma
cruzi) 		PF00067
(p450) 		3 LEU A 188
VAL A 245
ARG A 247
 None
 0.78A 3b0wB-3kswA:
undetectable		 3b0wB-3kswA:
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.
3m65 ATP-DEPENDENT
PROTEASE LA 1

(Bacillus
subtilis) 		PF02190
(LON_substr_bdg) 		3 LEU A  89
VAL A  29
ARG A  87
 None
 0.91A 3b0wB-3m65A:
undetectable		 3b0wB-3m65A:
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.
3m99 UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 8

(Saccharomyces
cerevisiae) 		PF00443
(UCH)
PF02148
(zf-UBP) 		3 LEU A 136
VAL A 191
ARG A 132
 None
 0.80A 3b0wB-3m99A:
undetectable		 3b0wB-3m99A:
18.01
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.
3mvd REGULATOR OF
CHROMOSOME
CONDENSATION

(Drosophila
melanogaster) 		PF00415
(RCC1) 		3 LEU K 402
VAL K  88
ARG K  38
 None
 0.87A 3b0wB-3mvdK:
undetectable		 3b0wB-3mvdK:
20.42
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.
3nbi RECQ-MEDIATED GENOME
INSTABILITY PROTEIN
1

(Homo sapiens) 		PF08585
(RMI1_N) 		3 LEU A 157
VAL A  95
ARG A 133
 None
 0.63A 3b0wB-3nbiA:
undetectable		 3b0wB-3nbiA:
19.76
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.
3nwa ENVELOPE
GLYCOPROTEIN B

(Human
alphaherpesvirus
1) 		no annotation 3 LEU B 330
VAL B 276
ARG B 245
 None
 0.70A 3b0wB-3nwaB:
undetectable		 3b0wB-3nwaB:
14.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q2r GLIOMA
PATHOGENESIS-RELATED
PROTEIN 1

(Homo sapiens) 		PF00188
(CAP) 		3 LEU A  56
VAL A  38
ARG A  45
 None
 0.91A 3b0wB-3q2rA:
undetectable		 3b0wB-3q2rA:
21.71
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.
3qy3 THIOESTERASE

(Pseudomonas
aeruginosa) 		PF13279
(4HBT_2) 		3 LEU A  34
VAL A  90
ARG A  38
 None
 0.71A 3b0wB-3qy3A:
undetectable		 3b0wB-3qy3A:
20.82
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.
3rr5 DNA LIGASE

(Thermococcus
sp. 1519) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		3 LEU A 406
VAL A 314
ARG A 319
 None
 0.88A 3b0wB-3rr5A:
undetectable		 3b0wB-3rr5A:
18.77
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.
3se7 VANA

(-) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 LEU A 111
VAL A  72
ARG A  70
 None
 0.84A 3b0wB-3se7A:
undetectable		 3b0wB-3se7A:
21.47
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.
3t57 UDP-N-ACETYLGLUCOSAM
INE
O-ACYLTRANSFERASE
DOMAIN-CONTAINING
PROTEIN

(Arabidopsis
thaliana) 		PF00132
(Hexapep)
PF13720
(Acetyltransf_11) 		3 LEU A 105
VAL A 122
ARG A 156
 None
 0.64A 3b0wB-3t57A:
undetectable		 3b0wB-3t57A:
21.02
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.
3tat TYROSINE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		3 LEU A 248
VAL A 272
ARG A  99
 None
 0.86A 3b0wB-3tatA:
undetectable		 3b0wB-3tatA:
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.
3va8 PROBABLE DEHYDRATASE

(Fusarium
graminearum) 		PF13378
(MR_MLE_C) 		3 LEU A 341
VAL A 371
ARG A 140
 None
 0.84A 3b0wB-3va8A:
undetectable		 3b0wB-3va8A:
19.73
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.
3vdg PROBABLE GLUCARATE
DEHYDRATASE

(Mycolicibacterium
smegmatis) 		PF13378
(MR_MLE_C) 		3 LEU A 343
VAL A 371
ARG A 142
 None
 0.81A 3b0wB-3vdgA:
undetectable		 3b0wB-3vdgA:
17.74
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.
4b8x POSSIBLE
MARR-TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF12802
(MarR_2) 		3 LEU A  66
VAL A 126
ARG A 124
 None
 0.84A 3b0wB-4b8xA:
undetectable		 3b0wB-4b8xA:
20.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b98 BETA-ALANINE--PYRUVA
TE TRANSAMINASE

(Pseudomonas
aeruginosa) 		PF00202
(Aminotran_3) 		3 LEU A  57
VAL A 261
ARG A 267
 None
PXG  A 470 (-4.0A)
None
 0.88A 3b0wB-4b98A:
undetectable		 3b0wB-4b98A:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bzi SAR1P

(Saccharomyces
cerevisiae) 		PF00025
(Arf) 		3 LEU B 122
VAL B 128
ARG B 164
 None
 0.89A 3b0wB-4bziB:
undetectable		 3b0wB-4bziB:
20.80
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.
4cuo BANYAN PEROXIDASE

(Ficus
benghalensis) 		PF00141
(peroxidase) 		3 LEU A  54
VAL A  95
ARG A 296
 None
 0.88A 3b0wB-4cuoA:
undetectable		 3b0wB-4cuoA:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4exn INTERLEUKIN-34

(Mus musculus) 		PF15036
(IL34) 		3 LEU A 133
VAL A  85
ARG A  88
 None
 0.87A 3b0wB-4exnA:
undetectable		 3b0wB-4exnA:
21.81
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.
4hly K9

(Human
gammaherpesvirus
8) 		PF00605
(IRF) 		3 LEU A  39
VAL A  54
ARG A  75
 None
 0.85A 3b0wB-4hlyA:
undetectable		 3b0wB-4hlyA:
19.01
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.
4js5 EXODEOXYRIBONUCLEASE
I

(Escherichia
coli) 		PF00929
(RNase_T)
PF08411
(Exonuc_X-T_C) 		3 LEU A  91
VAL A  42
ARG A  35
 None
 0.79A 3b0wB-4js5A:
undetectable		 3b0wB-4js5A:
19.92
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.
4k7c AMINOPEPTIDASE C

(Lactobacillus
rhamnosus) 		PF03051
(Peptidase_C1_2) 		3 LEU A 257
VAL A 285
ARG A 289
 None
 0.83A 3b0wB-4k7cA:
undetectable		 3b0wB-4k7cA:
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.
4mh4 OSMC-LIKE PROTEIN

(Burkholderia
cenocepacia) 		PF02566
(OsmC) 		3 LEU A  73
VAL A  80
ARG A  76
 None
 0.87A 3b0wB-4mh4A:
undetectable		 3b0wB-4mh4A:
20.73
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.
4o7p MALTOKINASE

(Mycobacterium
tuberculosis) 		no annotation 3 LEU A  65
VAL A 162
ARG A 160
 None
 0.85A 3b0wB-4o7pA:
undetectable		 3b0wB-4o7pA:
20.17
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.
4q8h PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Saccharomyces
cerevisiae) 		PF00929
(RNase_T)
PF13423
(UCH_1) 		3 LEU A 537
VAL A1002
ARG A1000
 None
 0.78A 3b0wB-4q8hA:
undetectable		 3b0wB-4q8hA:
16.77
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.
4qiw DNA-DIRECTED RNA
POLYMERASE SUBUNIT
A''
DNA-DIRECTED RNA
POLYMERASE SUBUNIT H

(Thermococcus
kodakarensis) 		PF01191
(RNA_pol_Rpb5_C)
PF04998
(RNA_pol_Rpb1_5) 		3 LEU C 314
VAL H  80
ARG H  77
 None
 0.74A 3b0wB-4qiwC:
undetectable		 3b0wB-4qiwC:
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.
4qmk TYPE III SECRETION
SYSTEM EFFECTOR
PROTEIN EXOU

(Pseudomonas
fluorescens) 		PF01734
(Patatin) 		3 LEU A 315
VAL A  30
ARG A  33
 None
 0.91A 3b0wB-4qmkA:
undetectable		 3b0wB-4qmkA:
17.78
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.
4red 5'-AMP-ACTIVATED
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA-1

(Homo sapiens) 		PF00069
(Pkinase) 		3 LEU A 162
VAL A 137
ARG A 140
 None
 0.86A 3b0wB-4redA:
undetectable		 3b0wB-4redA:
20.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uhm OMEGA AMINO
ACID-PYRUVATE
AMINOTRANSFERASE

(Pseudomonas sp.) 		PF00202
(Aminotran_3) 		3 LEU A  57
VAL A 261
ARG A 267
 None
PLP  A1458 (-4.1A)
None
 0.84A 3b0wB-4uhmA:
undetectable		 3b0wB-4uhmA:
18.34
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.
4wl2 PUTATIVE EXPORTED
CHOLOYLGLYCINE
HYDROLASE

(Pectobacterium
atrosepticum) 		PF02275
(CBAH) 		3 LEU A 153
VAL A 281
ARG A   3
 None
 0.86A 3b0wB-4wl2A:
undetectable		 3b0wB-4wl2A:
20.74
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.
5aog CATIONIC PEROXIDASE
SPC4

(Sorghum bicolor) 		PF00141
(peroxidase) 		3 LEU A  93
VAL A 136
ARG A 330
 None
 0.90A 3b0wB-5aogA:
undetectable		 3b0wB-5aogA:
22.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c4t NUCLEAR RECEPTOR
ROR-GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		3 LEU A 287
VAL A 361
ARG A 367
 None
 0.30A 3b0wB-5c4tA:
34.2		 3b0wB-5c4tA:
99.59
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.
5chv UBL
CARBOXYL-TERMINAL
HYDROLASE 18

(Mus musculus) 		PF00443
(UCH) 		3 LEU A 300
VAL A 338
ARG A 320
 None
 0.91A 3b0wB-5chvA:
undetectable		 3b0wB-5chvA:
20.30
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.
5ejj UFM1-SPECIFIC
PROTEASE

(Caenorhabditis
elegans) 		PF07910
(Peptidase_C78) 		3 LEU A  80
VAL A 255
ARG A 277
 None
 0.75A 3b0wB-5ejjA:
undetectable		 3b0wB-5ejjA:
18.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g23 TYPE-IV LIKE PILIN
TTHA1219

(Thermus
thermophilus) 		no annotation 3 LEU A  67
VAL A 173
ARG A 236
 None
 0.88A 3b0wB-5g23A:
undetectable		 3b0wB-5g23A:
23.61
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.
5jcp ARF-GAP WITH RHO-GAP
DOMAIN, ANK REPEAT
AND PH
DOMAIN-CONTAINING
PROTEIN
3,LINKER,TRANSFORMIN
G PROTEIN RHOA

(Homo sapiens;
synthetic
construct) 		no annotation 3 LEU B1023
VAL B1087
ARG B1028
 None
 0.81A 3b0wB-5jcpB:
undetectable		 3b0wB-5jcpB:
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.
5jjt SERINE/THREONINE-PRO
TEIN PHOSPHATASE 5

(Arabidopsis
thaliana) 		PF00149
(Metallophos)
PF00515
(TPR_1)
PF08321
(PPP5)
PF13431
(TPR_17) 		3 LEU A 209
VAL A 320
ARG A 357
 None
 0.82A 3b0wB-5jjtA:
undetectable		 3b0wB-5jjtA:
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.
5jjx SQUAMOUS CELL
CARCINOMA ANTIGEN
RECOGNIZED BY
T-CELLS 3

(Homo sapiens) 		no annotation 3 LEU A 337
VAL A 364
ARG A 370
 None
None
UNX  A 402 ( 4.0A)
 0.90A 3b0wB-5jjxA:
undetectable		 3b0wB-5jjxA:
23.38
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.
5jwy PHOSPHATIDYLGLYCEROP
HOSPHATASE B

(Escherichia
coli) 		PF01569
(PAP2) 		3 LEU A 237
VAL A 175
ARG A 181
 None
 0.87A 3b0wB-5jwyA:
3.7		 3b0wB-5jwyA:
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.
5lfn CHONDROADHERIN

(Homo sapiens) 		PF00560
(LRR_1)
PF01462
(LRRNT)
PF13855
(LRR_8) 		3 LEU A 173
VAL A 221
ARG A 174
 None
 0.82A 3b0wB-5lfnA:
undetectable		 3b0wB-5lfnA:
23.43
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.
5lmx DNA-DIRECTED RNA
POLYMERASES I AND
III SUBUNIT
RPAC1,DNA-DIRECTED
RNA POLYMERASES I
AND III SUBUNIT
RPAC1

(Saccharomyces
cerevisiae) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		3 LEU C 192
VAL C  91
ARG C 100
 LEU  C 192 ( 0.6A)
VAL  C  91 ( 0.6A)
ARG  C 100 ( 0.6A)
 0.83A 3b0wB-5lmxC:
undetectable		 3b0wB-5lmxC:
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.
5nnl INACTIVE
DIHYDROOROTASE-LIKE
DOMAIN

(Chaetomium
thermophilum) 		no annotation 3 LEU A1702
VAL A1768
ARG A1772
 None
 0.86A 3b0wB-5nnlA:
undetectable		 3b0wB-5nnlA:
20.17
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.
5o98 ALCOHOL
DEHYDROGENASE 1

(Catharanthus
roseus) 		no annotation 3 LEU A 280
VAL A  92
ARG A 161
 None
 0.85A 3b0wB-5o98A:
undetectable		 3b0wB-5o98A:
16.88
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.
5ohk UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE
30,UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE
30,UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 30

(Homo sapiens) 		PF00443
(UCH) 		3 LEU A 127
VAL A 442
ARG A 457
 None
 0.69A 3b0wB-5ohkA:
undetectable		 3b0wB-5ohkA:
21.49
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.
5ol2 ELECTRON TRANSFER
FLAVOPROTEIN LARGE
SUBUNIT
ELECTRON TRANSFER
FLAVOPROTEIN SMALL
SUBUNIT

(Clostridioides
difficile) 		no annotation 3 LEU B 142
VAL B 132
ARG A 107
 None
FAD  B 300 (-3.8A)
None
 0.89A 3b0wB-5ol2B:
undetectable		 3b0wB-5ol2B:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5szu ACYL-COA HYDROLASE

(Neisseria
meningitidis) 		PF03061
(4HBT) 		3 LEU A   7
VAL A  41
ARG A  48
 None
 0.84A 3b0wB-5szuA:
undetectable		 3b0wB-5szuA:
20.25
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.
5twt PEROXIDASE PVI9

(Panicum
virgatum) 		PF00141
(peroxidase) 		3 LEU A  54
VAL A  93
ARG A 284
 None
 0.88A 3b0wB-5twtA:
undetectable		 3b0wB-5twtA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v4a GLYCOSYLTRANSFERASE
(DUF1792)

(Streptococcus
sanguinis) 		PF08759
(GT-D) 		3 LEU A 143
VAL A 187
ARG A 194
 None
 0.82A 3b0wB-5v4aA:
undetectable		 3b0wB-5v4aA:
21.31
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.
5wt4 CYSTEINE DESULFURASE
ISCS

(Helicobacter
pylori) 		no annotation 3 LEU A 224
VAL A  67
ARG A 237
 None
 0.84A 3b0wB-5wt4A:
undetectable		 3b0wB-5wt4A:
12.03
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.
5x8g 2-SUCCINYLBENZOATE--
COA LIGASE

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 LEU A 180
VAL A 233
ARG A 258
 None
None
PEG  A 508 ( 4.1A)
 0.72A 3b0wB-5x8gA:
undetectable		 3b0wB-5x8gA:
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.
5xbc NSP1 PROTEIN

(Porcine
epidemic
diarrhea virus) 		no annotation 3 LEU A 110
VAL A  74
ARG A 107
 None
 0.85A 3b0wB-5xbcA:
undetectable		 3b0wB-5xbcA:
15.23
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.
5xon TRANSCRIPTION
ELONGATION FACTOR
SPT4

(Komagataella
phaffii) 		PF06093
(Spt4) 		3 LEU V  72
VAL V  18
ARG V 108
 None
 0.84A 3b0wB-5xonV:
undetectable		 3b0wB-5xonV:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c33 5'-3' EXONUCLEASE

(Mycolicibacterium
smegmatis) 		no annotation 3 LEU A 231
VAL A 266
ARG A 268
 None
 0.79A 3b0wB-6c33A:
undetectable		 3b0wB-6c33A:
14.98