SIMILAR PATTERNS OF AMINO ACIDS FOR 3B0W_A_DGXA1_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.
1b1y PROTEIN
(BETA-AMYLASE)

(Hordeum vulgare) 		PF01373
(Glyco_hydro_14) 		3 TRP A 299
VAL A 364
ARG A 370
 None
 0.92A 3b0wA-1b1yA:
0.0		 3b0wA-1b1yA:
17.57
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.
1dle COMPLEMENT FACTOR B

(Homo sapiens) 		PF00089
(Trypsin) 		3 TRP A 237
VAL A  66
ARG A  81
 None
 0.87A 3b0wA-1dleA:
0.0		 3b0wA-1dleA:
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.
1fo0 PROTEIN (BM3.3 T
CELL RECEPTOR
BETA-CHAIN)

(Mus musculus) 		PF07686
(V-set) 		3 TRP B  34
VAL B  13
ARG B  15
 None
 0.93A 3b0wA-1fo0B:
0.0		 3b0wA-1fo0B:
15.64
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.
1hxm GAMMA-DELTA T-CELL
RECEPTOR

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 TRP A  37
VAL A  13
ARG A 120
 None
 0.95A 3b0wA-1hxmA:
0.0		 3b0wA-1hxmA:
18.70
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.
1jft PURINE NUCLEOTIDE
SYNTHESIS REPRESSOR

(Escherichia
coli) 		PF00356
(LacI)
PF13377
(Peripla_BP_3) 		3 TRP A 215
VAL A 331
ARG A 328
 None
 0.73A 3b0wA-1jftA:
0.0		 3b0wA-1jftA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		3 TRP A 183
VAL A 367
ARG A 364
 None
 0.85A 3b0wA-1knrA:
0.0		 3b0wA-1knrA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ni6 HEME OXYGENASE 1

(Homo sapiens) 		PF01126
(Heme_oxygenase) 		3 TRP A 101
VAL A 115
ARG A 113
 None
 0.98A 3b0wA-1ni6A:
0.0		 3b0wA-1ni6A:
19.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nq7 NUCLEAR RECEPTOR
ROR-BETA

(Rattus
norvegicus) 		PF00104
(Hormone_recep) 		3 TRP A 259
VAL A 303
ARG A 309
 None
ARL  A 800 ( 4.7A)
ARL  A 800 ( 4.9A)
 0.71A 3b0wA-1nq7A:
28.5		 3b0wA-1nq7A:
49.80
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.
1ovm INDOLE-3-PYRUVATE
DECARBOXYLASE

(Enterobacter
cloacae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 TRP A  46
VAL A  96
ARG A 222
 None
 0.71A 3b0wA-1ovmA:
0.0		 3b0wA-1ovmA:
17.90
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.
1sqh HYPOTHETICAL PROTEIN
CG14615-PA

(Drosophila
melanogaster) 		PF08445
(FR47) 		3 TRP A 271
VAL A 135
ARG A 142
 None
 0.67A 3b0wA-1sqhA:
undetectable		 3b0wA-1sqhA:
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.
1t1j HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF09152
(DUF1937) 		3 TRP A  65
VAL A  39
ARG A   2
 None
 0.98A 3b0wA-1t1jA:
undetectable		 3b0wA-1t1jA:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ywq NITROREDUCTASE
FAMILY PROTEIN

(Bacillus cereus) 		PF00881
(Nitroreductase) 		3 TRP A 170
VAL A 136
ARG A  15
 None
 0.69A 3b0wA-1ywqA:
undetectable		 3b0wA-1ywqA:
21.51
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.
2c1z UDP-GLUCOSE
FLAVONOID 3-O
GLYCOSYLTRANSFERASE

(Vitis vinifera) 		PF00201
(UDPGT) 		3 TRP A 264
VAL A 364
ARG A 426
 None
 0.96A 3b0wA-2c1zA:
undetectable		 3b0wA-2c1zA:
20.53
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.
2cev PROTEIN (ARGINASE)

([Bacillus]
caldovelox) 		PF00491
(Arginase) 		3 TRP A 120
VAL A  82
ARG A  90
 None
 0.75A 3b0wA-2cevA:
undetectable		 3b0wA-2cevA:
22.47
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.
2csg PUTATIVE CYTOPLASMIC
PROTEIN

(Salmonella
enterica) 		PF07350
(DUF1479) 		3 TRP A 212
VAL A 279
ARG A  85
 None
 0.94A 3b0wA-2csgA:
undetectable		 3b0wA-2csgA:
18.40
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.
2dbn HYPOTHETICAL PROTEIN
YBIU

(Escherichia
coli) 		PF07350
(DUF1479) 		3 TRP A 212
VAL A 279
ARG A  85
 None
 0.88A 3b0wA-2dbnA:
undetectable		 3b0wA-2dbnA:
18.90
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.
2fff PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		3 TRP B 648
VAL B 564
ARG B 456
 None
 0.98A 3b0wA-2fffB:
undetectable		 3b0wA-2fffB:
18.62
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.
2fff PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		3 TRP B 712
VAL B 422
ARG B 419
 None
 0.80A 3b0wA-2fffB:
undetectable		 3b0wA-2fffB:
18.62
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.
2hmc DIHYDRODIPICOLINATE
SYNTHASE

(Agrobacterium
fabrum) 		PF00701
(DHDPS) 		3 TRP A 308
VAL A 201
ARG A 173
 None
 0.95A 3b0wA-2hmcA:
undetectable		 3b0wA-2hmcA:
18.64
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.
2j3e T7I23.11 PROTEIN

(Arabidopsis
thaliana) 		PF04548
(AIG1) 		3 TRP A 229
VAL A 119
ARG A 245
 None
 0.93A 3b0wA-2j3eA:
undetectable		 3b0wA-2j3eA:
19.78
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.
2kkq MYOTILIN

(Homo sapiens) 		PF07679
(I-set) 		3 TRP A  49
VAL A  27
ARG A 110
 None
 0.66A 3b0wA-2kkqA:
undetectable		 3b0wA-2kkqA:
18.32
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.
2o5f PUTATIVE NUDIX
HYDROLASE DR_0079

(Deinococcus
radiodurans) 		PF00293
(NUDIX) 		3 TRP A  99
VAL A  72
ARG A  24
 None
 0.92A 3b0wA-2o5fA:
undetectable		 3b0wA-2o5fA:
21.29
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.
2uvk YJHT

(Escherichia
coli) 		PF01344
(Kelch_1) 		3 TRP A  98
VAL A 311
ARG A 307
 None
 0.84A 3b0wA-2uvkA:
undetectable		 3b0wA-2uvkA:
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.
2vk4 PYRUVATE
DECARBOXYLASE

(Kluyveromyces
lactis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 TRP A  45
VAL A  95
ARG A 224
 None
 0.86A 3b0wA-2vk4A:
undetectable		 3b0wA-2vk4A:
18.37
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.
2vyc BIODEGRADATIVE
ARGININE
DECARBOXYLASE

(Escherichia
coli) 		PF01276
(OKR_DC_1)
PF03709
(OKR_DC_1_N)
PF03711
(OKR_DC_1_C) 		3 TRP A 350
VAL A 586
ARG A 588
 PLP  A1386 (-4.0A)
None
None
 0.88A 3b0wA-2vycA:
undetectable		 3b0wA-2vycA:
15.24
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa) 		PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc) 		3 TRP A1592
VAL A1547
ARG A1523
 None
 0.95A 3b0wA-2vz9A:
undetectable		 3b0wA-2vz9A:
8.24
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.
2wd9 ACYL-COENZYME A
SYNTHETASE ACSM2A,
MITOCHONDRIAL

(Homo sapiens) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 TRP A 277
VAL A 111
ARG A 148
 None
 0.88A 3b0wA-2wd9A:
undetectable		 3b0wA-2wd9A:
17.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yd3 RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE S

(Homo sapiens) 		PF07679
(I-set) 		3 TRP A 168
VAL A 146
ARG A 228
 None
 0.92A 3b0wA-2yd3A:
undetectable		 3b0wA-2yd3A:
19.53
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.
2yl2 ACETYL-COA
CARBOXYLASE 1

(Homo sapiens) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		3 TRP A 246
VAL A 542
ARG A 604
 None
 0.94A 3b0wA-2yl2A:
undetectable		 3b0wA-2yl2A:
19.59
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.
2yn9 POTASSIUM-TRANSPORTI
NG ATPASE ALPHA
CHAIN 1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF09040
(H-K_ATPase_N)
PF13246
(Cation_ATPase) 		3 TRP A 401
VAL A 433
ARG A 480
 None
 0.86A 3b0wA-2yn9A:
undetectable		 3b0wA-2yn9A:
12.44
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.
2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE

(Photobacterium
sp. JT-ISH-224) 		PF11477
(PM0188) 		3 TRP A 282
VAL A 222
ARG A 193
 None
 0.91A 3b0wA-2z4tA:
undetectable		 3b0wA-2z4tA:
19.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zpa UNCHARACTERIZED
PROTEIN YPFI

(Escherichia
coli) 		PF05127
(Helicase_RecD)
PF08351
(DUF1726)
PF13718
(GNAT_acetyltr_2)
PF17176
(tRNA_bind_3) 		3 TRP A 501
VAL A 437
ARG A 433
 None
 0.80A 3b0wA-2zpaA:
undetectable		 3b0wA-2zpaA:
18.21
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.
3a5k TYROSINE-PROTEIN
PHOSPHATASE
NON-RECEPTOR TYPE 1

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 TRP A 179
VAL A  49
ARG A  47
 None
 0.97A 3b0wA-3a5kA:
undetectable		 3b0wA-3a5kA:
21.22
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.
3aoe GLUTAMATE
DEHYDROGENASE

(Thermus
thermophilus) 		no annotation 3 TRP E  97
VAL E  31
ARG E 413
 None
 0.92A 3b0wA-3aoeE:
undetectable		 3b0wA-3aoeE:
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.
3da0 CLEAVED CHIMERIC
RECEPTOR BINDING
PROTEIN FROM
BACTERIOPHAGES
TP901-1 AND P2

(Lactococcus
phage TP901-1;
Lactococcus
virus P2) 		PF08931
(Caudo_bapla_RBP) 		3 TRP A 144
VAL A 109
ARG A 111
 None
 0.89A 3b0wA-3da0A:
undetectable		 3b0wA-3da0A:
17.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dhu ALPHA-AMYLASE

(Lactobacillus
plantarum) 		PF00128
(Alpha-amylase) 		3 TRP A 243
VAL A 335
ARG A  37
 None
 0.97A 3b0wA-3dhuA:
undetectable		 3b0wA-3dhuA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eez PUTATIVE MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Ruegeria
pomeroyi) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A  53
VAL A 150
ARG A 148
 None
 0.91A 3b0wA-3eezA:
undetectable		 3b0wA-3eezA:
21.12
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.
3h9c METHIONYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF09334
(tRNA-synt_1g) 		3 TRP A 512
VAL A 389
ARG A 395
 None
 0.92A 3b0wA-3h9cA:
undetectable		 3b0wA-3h9cA:
19.71
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.
3i4y CATECHOL
1,2-DIOXYGENASE

(Rhodococcus
opacus) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		3 TRP A 154
VAL A 138
ARG A 185
 None
 0.91A 3b0wA-3i4yA:
undetectable		 3b0wA-3i4yA:
20.91
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.
3j23 CAPSID PROTEIN VP1

(Enterovirus A) 		PF00073
(Rhv) 		3 TRP A 109
VAL A 123
ARG A 264
 None
 0.76A 3b0wA-3j23A:
undetectable		 3b0wA-3j23A:
18.75
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.
3k92 NAD-SPECIFIC
GLUTAMATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		3 TRP A 362
VAL A 383
ARG A 381
 None
 0.96A 3b0wA-3k92A:
undetectable		 3b0wA-3k92A:
20.57
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.
3nwj ATSK2

(Arabidopsis
thaliana) 		PF01202
(SKI) 		3 TRP A 240
VAL A 268
ARG A 266
 None
 0.91A 3b0wA-3nwjA:
undetectable		 3b0wA-3nwjA:
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.
3q2i DEHYDROGENASE

(Chromobacterium
violaceum) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		3 TRP A 179
VAL A 194
ARG A 134
 None
 0.74A 3b0wA-3q2iA:
undetectable		 3b0wA-3q2iA:
19.78
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.
3q2k OXIDOREDUCTASE

(Bordetella
pertussis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		3 TRP A 178
VAL A 193
ARG A 133
 None
 0.82A 3b0wA-3q2kA:
undetectable		 3b0wA-3q2kA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r5e TRANSALDOLASE

(Corynebacterium
glutamicum) 		PF00923
(TAL_FSA) 		3 TRP A  15
VAL A 174
ARG A 172
 None
 0.98A 3b0wA-3r5eA:
undetectable		 3b0wA-3r5eA:
23.70
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.
3s6h N-ACETYLGLUTAMATE
KINASE /
N-ACETYLGLUTAMATE
SYNTHASE

(Maricaulis
maris) 		PF00696
(AA_kinase)
PF04768
(NAT) 		3 TRP A 325
VAL A 372
ARG A 370
 None
 0.93A 3b0wA-3s6hA:
undetectable		 3b0wA-3s6hA:
18.70
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.
3up1 INTERLEUKIN-7
RECEPTOR SUBUNIT
ALPHA

(Homo sapiens) 		PF00041
(fn3) 		3 TRP A 158
VAL A 117
ARG A 120
 None
None
GOL  A 906 ( 4.5A)
 0.78A 3b0wA-3up1A:
undetectable		 3b0wA-3up1A:
22.64
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.
3vil BETA-GLUCOSIDASE

(Neotermes
koshunensis) 		PF00232
(Glyco_hydro_1) 		3 TRP A 256
VAL A 295
ARG A 302
 None
 0.84A 3b0wA-3vilA:
undetectable		 3b0wA-3vilA:
18.28
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.
3zys DYNAMIN-1

(Homo sapiens) 		PF00169
(PH) 		3 TRP C 108
VAL C  88
ARG C  86
 None
 0.69A 3b0wA-3zysC:
undetectable		 3b0wA-3zysC:
20.68
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.
4aah METHANOL
DEHYDROGENASE

(Methylophilus
methylotrophus) 		PF13360
(PQQ_2) 		3 TRP A 458
VAL A 305
ARG A 333
 None
 0.88A 3b0wA-4aahA:
undetectable		 3b0wA-4aahA:
16.96
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.
4ak2 BT_4661

(Bacteroides
thetaiotaomicron) 		PF16319
(DUF4958) 		3 TRP A 612
VAL A 554
ARG A 558
 None
 0.97A 3b0wA-4ak2A:
undetectable		 3b0wA-4ak2A:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bn7 COPPER INDUCED
NITROREDUCTASE D

(Lactococcus
lactis) 		PF00881
(Nitroreductase) 		3 TRP A 171
VAL A 137
ARG A  10
 None
None
FMN  A 504 (-3.0A)
 0.83A 3b0wA-4bn7A:
undetectable		 3b0wA-4bn7A:
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.
4elx 1,4-DIHYDROXY-2-NAPH
THOYL-COA SYNTHASE

(Escherichia
coli) 		PF00378
(ECH_1) 		3 TRP A 166
VAL A  53
ARG A  41
 None
 0.75A 3b0wA-4elxA:
undetectable		 3b0wA-4elxA:
22.26
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.
4g7a CARBONATE
DEHYDRATASE

(Sulfurihydrogenibium
sp. YO3AOP1) 		PF00194
(Carb_anhydrase) 		3 TRP A   3
VAL A 120
ARG A 183
 None
AZM  A 302 ( 4.8A)
None
 0.78A 3b0wA-4g7aA:
undetectable		 3b0wA-4g7aA:
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.
4hq6 ACETYL-COA
CARBOXYLASE 2

(Homo sapiens) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		3 TRP A 351
VAL A 648
ARG A 710
 None
 0.93A 3b0wA-4hq6A:
undetectable		 3b0wA-4hq6A:
18.37
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.
4hv6 TRANSCRIPTIONAL
REGULATOR MNTR

(Bacillus
subtilis) 		PF01325
(Fe_dep_repress)
PF02742
(Fe_dep_repr_C) 		3 TRP A 107
VAL A 117
ARG A 126
 None
 0.85A 3b0wA-4hv6A:
undetectable		 3b0wA-4hv6A:
21.28
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.
4hvt POST-PROLINE
CLEAVING ENZYME

(Rickettsia
typhi) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		3 TRP A 504
VAL A 572
ARG A 535
 None
 0.89A 3b0wA-4hvtA:
undetectable		 3b0wA-4hvtA:
15.07
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.
4ibn RIBONUCLEASE H

(uncultured
organism) 		PF00075
(RNase_H) 		3 TRP A 111
VAL A 136
ARG A  88
 None
 0.98A 3b0wA-4ibnA:
undetectable		 3b0wA-4ibnA:
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.
4iu4 ARGINASE

(Leishmania
mexicana) 		PF00491
(Arginase) 		3 TRP A 135
VAL A  97
ARG A 105
 None
 0.75A 3b0wA-4iu4A:
undetectable		 3b0wA-4iu4A:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jnt ENVELOPE
GLYCOPROTEIN E2

(Pestivirus A) 		PF16329
(Pestivirus_E2) 		3 TRP A 879
VAL A 830
ARG A 846
 NAG  A2401 (-3.6A)
None
None
 0.93A 3b0wA-4jntA:
undetectable		 3b0wA-4jntA:
22.25
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.
4lgv GLUCOSE-6-PHOSPHATE
1-DEHYDROGENASE

(Mycobacterium
avium) 		PF00479
(G6PD_N)
PF02781
(G6PD_C) 		3 TRP A 441
VAL A 230
ARG A 228
 None
 0.85A 3b0wA-4lgvA:
undetectable		 3b0wA-4lgvA:
20.22
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.
4nj5 PROBABLE
HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC
SUVH9

(Arabidopsis
thaliana) 		PF00856
(SET)
PF02182
(SAD_SRA)
PF05033
(Pre-SET) 		3 TRP A 556
VAL A 224
ARG A 199
 None
 0.70A 3b0wA-4nj5A:
undetectable		 3b0wA-4nj5A:
19.50
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.
4ofd KIN OF IRRE-LIKE
PROTEIN 1

(Mus musculus) 		PF07679
(I-set)
PF08205
(C2-set_2) 		3 TRP A  57
VAL A 120
ARG A 182
 None
 0.91A 3b0wA-4ofdA:
undetectable		 3b0wA-4ofdA:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q82 PHOSPHOLIPASE/CARBOX
YLESTERASE

(Haliangium
ochraceum) 		no annotation 3 TRP A 286
VAL A 140
ARG A  67
 None
 0.97A 3b0wA-4q82A:
undetectable		 3b0wA-4q82A:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wd4 HEME OXYGENASE 1

(Homo sapiens) 		PF01126
(Heme_oxygenase) 		3 TRP A 101
VAL A 115
ARG A 113
 None
 0.85A 3b0wA-4wd4A:
undetectable		 3b0wA-4wd4A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wd9 NISIN BIOSYNTHESIS
PROTEIN NISB

(Lactococcus
lactis) 		PF04738
(Lant_dehydr_N)
PF14028
(Lant_dehydr_C) 		3 TRP A 737
VAL A 962
ARG A 972
 None
 0.96A 3b0wA-4wd9A:
undetectable		 3b0wA-4wd9A:
13.82
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.
4wk7 A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 4

(Homo sapiens) 		PF01421
(Reprolysin) 		3 TRP A 404
VAL A 348
ARG A 318
 None
 0.75A 3b0wA-4wk7A:
undetectable		 3b0wA-4wk7A:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xpr ALPHA-GLUCOSIDASE

(Pseudopedobacter
saltans) 		PF01055
(Glyco_hydro_31)
PF17137
(DUF5110) 		3 TRP A 330
VAL A 398
ARG A 343
 None
 0.91A 3b0wA-4xprA:
undetectable		 3b0wA-4xprA:
15.41
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.
4ywo MERCURIC REDUCTASE

(Metallosphaera
sedula) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 TRP A 148
VAL A 216
ARG A 208
 None
 0.97A 3b0wA-4ywoA:
undetectable		 3b0wA-4ywoA:
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.
4zmh UNCHARACTERIZED
PROTEIN

(Saccharophagus
degradans) 		PF15979
(Glyco_hydro_115) 		3 TRP A 312
VAL A 382
ARG A 410
 None
 0.89A 3b0wA-4zmhA:
undetectable		 3b0wA-4zmhA:
13.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zrs ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		3 TRP A 245
VAL A 288
ARG A 286
 GOL  A 301 (-4.3A)
None
None
 0.87A 3b0wA-4zrsA:
undetectable		 3b0wA-4zrsA:
21.23
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.
4zxk SIALIDASE A

(Streptococcus
pneumoniae) 		PF02973
(Sialidase) 		3 TRP A 280
VAL A 154
ARG A 304
 None
 0.75A 3b0wA-4zxkA:
undetectable		 3b0wA-4zxkA:
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.
5a3f DYNAMIN 3

(Homo sapiens) 		PF00169
(PH)
PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF02212
(GED) 		3 TRP A 612
VAL A 592
ARG A 590
 None
 0.83A 3b0wA-5a3fA:
undetectable		 3b0wA-5a3fA:
16.03
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.
5b6t GLYCOSYL HYDROLASE
FAMILY 62 PROTEIN

(Coprinopsis
cinerea) 		PF03664
(Glyco_hydro_62) 		3 TRP A 340
VAL A 121
ARG A 118
 None
 0.97A 3b0wA-5b6tA:
undetectable		 3b0wA-5b6tA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE

(Mycolicibacterium
smegmatis) 		PF14765
(PS-DH) 		3 TRP A 930
VAL A 998
ARG A1006
 None
 0.86A 3b0wA-5bp3A:
undetectable		 3b0wA-5bp3A:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bpt MGC81278 PROTEIN

(Xenopus laevis) 		PF12894
(ANAPC4_WD40)
PF12896
(ANAPC4) 		3 TRP A 108
VAL A  31
ARG A 732
 None
 0.87A 3b0wA-5bptA:
undetectable		 3b0wA-5bptA:
16.28
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.
5bwd BENZYLSUCCINATE
SYNTHASE ALPHA CHAIN

(Thauera
aromatica) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		3 TRP A 488
VAL A 444
ARG A 442
 None
 0.86A 3b0wA-5bwdA:
undetectable		 3b0wA-5bwdA:
14.95
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 TRP A 317
VAL A 361
ARG A 367
 None
 0.40A 3b0wA-5c4tA:
33.4		 3b0wA-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.
5cfe EXODEOXYRIBONUCLEASE

(Bacillus
subtilis) 		PF03372
(Exo_endo_phos) 		3 TRP A 201
VAL A  14
ARG A  12
 None
 0.95A 3b0wA-5cfeA:
undetectable		 3b0wA-5cfeA:
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.
5d9a POLYMERASE ACIDIC
PROTEIN
RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza C
virus) 		PF00602
(Flu_PB1)
PF00603
(Flu_PA) 		3 TRP A 388
VAL A 399
ARG B 550
 None
 0.86A 3b0wA-5d9aA:
undetectable		 3b0wA-5d9aA:
15.75
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.
5dkx ALPHA
GLUCOSIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF17137
(DUF5110) 		3 TRP A 141
VAL A 614
ARG A 689
 None
 0.87A 3b0wA-5dkxA:
undetectable		 3b0wA-5dkxA:
12.82
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.
5fll 6-CARBOXYHEXANOATE-C
OA LIGASE

(Bacillus
subtilis) 		PF03744
(BioW) 		3 TRP A 119
VAL A 204
ARG A 213
 None
None
WAQ  A 700 (-3.8A)
 0.97A 3b0wA-5fllA:
undetectable		 3b0wA-5fllA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gkv ESTERASE A

(Caulobacter
vibrioides) 		PF00144
(Beta-lactamase) 		3 TRP A 244
VAL A  73
ARG A  80
 None
 0.94A 3b0wA-5gkvA:
undetectable		 3b0wA-5gkvA:
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.
5hzg F-BOX/LRR-REPEAT
MAX2 HOMOLOG

(Oryza sativa) 		no annotation 3 TRP B 178
VAL B 216
ARG B 218
 None
 0.93A 3b0wA-5hzgB:
undetectable		 3b0wA-5hzgB:
14.92
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.
5ijl DNA POLYMERASE II
LARGE SUBUNIT

(Pyrococcus
abyssi) 		PF03833
(PolC_DP2) 		3 TRP A 540
VAL A 603
ARG A 599
 None
 0.91A 3b0wA-5ijlA:
undetectable		 3b0wA-5ijlA:
13.46
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.
5jri PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE

(Synechocystis
sp. PCC 6803) 		no annotation 3 TRP A 270
VAL A 108
ARG A 123
 SO4  A 407 (-3.4A)
None
None
 0.89A 3b0wA-5jriA:
undetectable		 3b0wA-5jriA:
18.93
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.
5jvk UNCHARACTERIZED
PROTEIN

(Bacteroides
cellulosilyticus) 		no annotation 3 TRP A 472
VAL A 399
ARG A 160
 None
None
GOL  A 654 (-4.0A)
 0.60A 3b0wA-5jvkA:
undetectable		 3b0wA-5jvkA:
16.61
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.
5k9n POLYAMINE N
ACETYLTRANSFERASE

(Drosophila
melanogaster) 		PF00583
(Acetyltransf_1) 		3 TRP A 100
VAL A 209
ARG A 187
 None
 0.93A 3b0wA-5k9nA:
undetectable		 3b0wA-5k9nA:
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.
5lrb ALPHA-1,4 GLUCAN
PHOSPHORYLASE

(Hordeum vulgare) 		PF00343
(Phosphorylase) 		3 TRP A 263
VAL A 568
ARG A 478
 None
 0.96A 3b0wA-5lrbA:
undetectable		 3b0wA-5lrbA:
13.33
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.
5ogs WD REPEAT AND
HMG-BOX DNA-BINDING
PROTEIN 1

(Homo sapiens) 		no annotation 3 TRP A 544
VAL A 448
ARG A 456
 None
 0.92A 3b0wA-5ogsA:
undetectable		 3b0wA-5ogsA:
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.
5ti8 AMINOTRANSFERASE

(Pseudomonas sp.
M1) 		PF00202
(Aminotran_3) 		3 TRP A 362
VAL A  44
ARG A  70
 None
 0.81A 3b0wA-5ti8A:
undetectable		 3b0wA-5ti8A:
19.71
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.
5vtm TYPE II SECRETION
SYSTEM PROTEIN J
TYPE II SECRETION
SYSTEM PROTEIN K

(Pseudomonas
aeruginosa) 		no annotation 3 TRP X  48
VAL W 111
ARG W 123
 None
 0.96A 3b0wA-5vtmX:
undetectable		 3b0wA-5vtmX:
19.02
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.
5xj1 UNCHARACTERIZED RNA
METHYLTRANSFERASE
SP_1029

(Streptococcus
pneumoniae) 		no annotation 3 TRP A 256
VAL A 134
ARG A 136
 None
 0.86A 3b0wA-5xj1A:
undetectable		 3b0wA-5xj1A:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xjj MULTI DRUG EFFLUX
TRANSPORTER

(Camelina sativa) 		PF01554
(MatE) 		3 TRP A 217
VAL A  85
ARG A 394
 None
 0.90A 3b0wA-5xjjA:
undetectable		 3b0wA-5xjjA:
21.00
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.
6al5 B-LYMPHOCYTE ANTIGEN
CD19

(Homo sapiens) 		no annotation 3 TRP A  52
VAL A  28
ARG A 277
 None
 0.76A 3b0wA-6al5A:
undetectable		 3b0wA-6al5A:
14.64
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.
6axf RAS GUANYL-RELEASING
PROTEIN 2

(Homo sapiens) 		no annotation 3 TRP A 206
VAL A 354
ARG A 351
 None
 0.82A 3b0wA-6axfA:
undetectable		 3b0wA-6axfA:
22.33
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.
6bk1 UDP-GLYCOSYLTRANSFER
ASE 79

(Oryza sativa) 		no annotation 3 TRP A 364
VAL A 179
ARG A 169
 None
 0.91A 3b0wA-6bk1A:
undetectable		 3b0wA-6bk1A:
13.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cdd NPL4 ZINC FINGER

(Chaetomium
thermophilum) 		no annotation 3 TRP A 346
VAL A 429
ARG A 459
 None
 0.88A 3b0wA-6cddA:
undetectable		 3b0wA-6cddA:
16.46
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.
6co9 PROBABLE
COA-TRANSFERASE
ALPHA SUBUNIT

(Rhodococcus
jostii) 		no annotation 3 TRP A  29
VAL A 132
ARG A 134
 F8G  B 302 ( 4.6A)
None
None
 0.85A 3b0wA-6co9A:
undetectable		 3b0wA-6co9A:
13.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6en3 ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE
F2,MULTIFUNCTIONAL-A
UTOPROCESSING
REPEATS-IN-TOXIN

(Streptococcus
pyogenes;
Vibrio cholerae) 		no annotation 3 TRP A 870
VAL A 787
ARG A 830
 None
 0.98A 3b0wA-6en3A:
undetectable		 3b0wA-6en3A:
17.99