SIMILAR PATTERNS OF AMINO ACIDS FOR 1JO4_B_DVAB6_0

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.
1bwu PROTEIN (AGGLUTININ)

(Allium sativum) 		PF01453
(B_lectin) 		3 ALA Q  55
VAL Q  64
TRP Q  74
 None
 0.90A 1jo4B-1bwuQ:
undetectable		 1jo4B-1bwuQ:
12.64
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.
1dbn PROTEIN
(LEUKOAGGLUTININ)

(Maackia
amurensis) 		PF00139
(Lectin_legB) 		3 ALA A  54
VAL A 211
TRP A 210
 None
 0.86A 1jo4B-1dbnA:
undetectable		 1jo4B-1dbnA:
12.77
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.
1edg ENDOGLUCANASE A

([Clostridium]
cellulolyticum) 		PF00150
(Cellulase) 		3 ALA A  41
VAL A  82
TRP A  99
 None
 0.90A 1jo4B-1edgA:
undetectable		 1jo4B-1edgA:
4.11
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.
1fnz BARK AGGLUTININ I,
POLYPEPTIDE A

(Robinia
pseudoacacia) 		PF00139
(Lectin_legB) 		3 ALA A  54
VAL A 206
TRP A 205
 None
 0.89A 1jo4B-1fnzA:
undetectable		 1jo4B-1fnzA:
4.22
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.
1hcy ARTHROPODAN
HEMOCYANIN

(Panulirus
interruptus) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		3 ALA A 284
VAL A 286
TRP A 248
 None
 0.92A 1jo4B-1hcyA:
undetectable		 1jo4B-1hcyA:
8.21
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.
1ml4 ASPARTATE
TRANSCARBAMOYLASE

(Pyrococcus
abyssi) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		3 ALA A 299
VAL A 304
TRP A   3
 None
 0.93A 1jo4B-1ml4A:
undetectable		 1jo4B-1ml4A:
6.45
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.
1r6v SUBTILISIN-LIKE
SERINE PROTEASE

(Fervidobacterium
pennivorans) 		PF00082
(Peptidase_S8) 		3 ALA A 218
VAL A 228
TRP A 156
 None
 0.87A 1jo4B-1r6vA:
undetectable		 1jo4B-1r6vA:
12.28
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.
1rbl RIBULOSE 1,5
BISPHOSPHATE
CARBOXYLASE/OXYGENAS
E (LARGE CHAIN)

(Synechococcus
elongatus) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  15
VAL A  17
TRP A  66
 None
 0.93A 1jo4B-1rblA:
undetectable		 1jo4B-1rblA:
4.08
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.
1rfo WHISKER ANTIGEN
CONTROL PROTEIN

(Escherichia
virus T4) 		PF07921
(Fibritin_C) 		3 ALA A  12
VAL A  21
TRP A  20
 None
 0.73A 1jo4B-1rfoA:
undetectable		 1jo4B-1rfoA:
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.
1sfr ANTIGEN 85-A

(Mycobacterium
tuberculosis) 		PF00756
(Esterase) 		3 ALA A 129
VAL A 123
TRP A  51
 None
 0.87A 1jo4B-1sfrA:
undetectable		 1jo4B-1sfrA:
5.04
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.
1sq4 GLYOXYLATE-INDUCED
PROTEIN

(Pseudomonas
aeruginosa) 		PF07883
(Cupin_2) 		3 ALA A 223
VAL A 232
TRP A 231
 None
 0.93A 1jo4B-1sq4A:
undetectable		 1jo4B-1sq4A:
6.88
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.
1ta3 ENDO-1,4-BETA-XYLANA
SE

(Aspergillus
nidulans) 		PF00331
(Glyco_hydro_10) 		3 ALA B 183
VAL B 188
TRP B 191
 None
 0.92A 1jo4B-1ta3B:
undetectable		 1jo4B-1ta3B:
4.09
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.
1xup GLYCEROL KINASE

(Enterococcus
casseliflavus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 ALA O  62
VAL O  57
TRP O  54
 None
 0.95A 1jo4B-1xupO:
undetectable		 1jo4B-1xupO:
4.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d4w GLYCEROL KINASE

(Cellulomonas
sp.) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 ALA A  99
VAL A  87
TRP A  88
 None
 0.96A 1jo4B-2d4wA:
undetectable		 1jo4B-2d4wA:
12.39
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.
2gdf LECTIN

(Dioclea
violacea) 		PF00139
(Lectin_legB) 		3 ALA A 177
VAL A  89
TRP A  88
 None
 0.95A 1jo4B-2gdfA:
undetectable		 1jo4B-2gdfA:
10.22
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.
2gen PROBABLE
TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		PF00440
(TetR_N) 		3 ALA A 192
VAL A 190
TRP A 187
 None
 0.62A 1jo4B-2genA:
undetectable		 1jo4B-2genA:
5.79
Potential target for repurposing, i.e. matched protein structure has less than 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) 		3 ALA A 818
VAL A 827
TRP A 825
 None
 0.93A 1jo4B-2gj4A:
undetectable		 1jo4B-2gj4A:
1.83
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.
2gup ROK FAMILY PROTEIN

(Streptococcus
pneumoniae) 		PF00480
(ROK) 		3 ALA A 204
VAL A 173
TRP A 185
 None
 0.91A 1jo4B-2gupA:
undetectable		 1jo4B-2gupA:
6.17
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.
2hor ALLIIN LYASE 1

(Allium sativum) 		PF04863
(EGF_alliinase)
PF04864
(Alliinase_C) 		3 ALA A 186
VAL A 158
TRP A 182
 None
 0.96A 1jo4B-2horA:
undetectable		 1jo4B-2horA:
8.78
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.
2ibl FIBRITIN

(Escherichia
virus T4;
Enterobacteria
phage Ox2) 		PF07921
(Fibritin_C) 		3 ALA A  94
VAL A 103
TRP A 102
 None
 0.91A 1jo4B-2iblA:
undetectable		 1jo4B-2iblA:
8.33
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.
2in3 HYPOTHETICAL PROTEIN

(Nitrosomonas
europaea) 		PF01323
(DSBA) 		3 ALA A 119
VAL A 122
TRP A  20
 None
 0.83A 1jo4B-2in3A:
undetectable		 1jo4B-2in3A:
13.64
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.
2jep XYLOGLUCANASE

(Paenibacillus
pabuli) 		PF00150
(Cellulase) 		3 ALA A  54
VAL A  90
TRP A 108
 None
 0.79A 1jo4B-2jepA:
undetectable		 1jo4B-2jepA:
5.88
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.
2jgp TYROCIDINE
SYNTHETASE 3

(Brevibacillus
brevis) 		PF00550
(PP-binding)
PF00668
(Condensation) 		3 ALA A  32
VAL A  30
TRP A  21
 None
 0.91A 1jo4B-2jgpA:
undetectable		 1jo4B-2jgpA:
5.16
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.
2jzk CYANOVIRIN-N HOMOLOG

(Tuber borchii) 		PF08881
(CVNH) 		3 ALA A  21
VAL A  31
TRP A  30
 None
 0.65A 1jo4B-2jzkA:
undetectable		 1jo4B-2jzkA:
12.96
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.
2mgy TRANSLOCATOR PROTEIN

(Mus musculus) 		PF03073
(TspO_MBR) 		3 ALA A 110
VAL A 115
TRP A 143
 PKA  A 201 (-2.9A)
None
None
 0.93A 1jo4B-2mgyA:
undetectable		 1jo4B-2mgyA:
8.07
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.
2ogj DIHYDROOROTASE

(Agrobacterium
fabrum) 		PF01979
(Amidohydro_1) 		3 ALA A 389
VAL A 100
TRP A  73
 None
 0.87A 1jo4B-2ogjA:
undetectable		 1jo4B-2ogjA:
3.10
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.
2v72 EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C) 		3 ALA A  64
VAL A 106
TRP A  97
 None
 0.80A 1jo4B-2v72A:
undetectable		 1jo4B-2v72A:
4.20
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.
2v89 VDJ
RECOMBINATION-ACTIVA
TING PROTEIN 2

(Mus musculus) 		PF13341
(RAG2_PHD) 		3 ALA A1442
VAL A1454
TRP A1453
 None
 0.90A 1jo4B-2v89A:
undetectable		 1jo4B-2v89A:
9.76
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.
2vou 2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE

(Paenarthrobacter
nicotinovorans) 		PF00070
(Pyr_redox) 		3 ALA A 317
VAL A  50
TRP A  93
 FAD  A1395 ( 4.5A)
None
None
 0.91A 1jo4B-2vouA:
undetectable		 1jo4B-2vouA:
3.86
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.
2xdq LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Thermosynechococcus
elongatus) 		PF00148
(Oxidored_nitro) 		3 ALA A 246
VAL A 200
TRP A 227
 None
 0.92A 1jo4B-2xdqA:
undetectable		 1jo4B-2xdqA:
2.87
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.
2xrm INTRACELLULAR
SUBTILISIN PROTEASE

(Bacillus
clausii) 		PF00082
(Peptidase_S8) 		3 ALA A  96
VAL A 106
TRP A  34
 None
 0.94A 1jo4B-2xrmA:
undetectable		 1jo4B-2xrmA:
4.87
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.
2z1k (NEO)PULLULANASE

(Thermus
thermophilus) 		PF00128
(Alpha-amylase) 		3 ALA A  74
VAL A  72
TRP A 191
 None
 0.76A 1jo4B-2z1kA:
undetectable		 1jo4B-2z1kA:
4.88
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.
2z2x TK-SUBTILISIN

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8) 		3 ALA A 163
VAL A 173
TRP A  99
 None
 0.84A 1jo4B-2z2xA:
undetectable		 1jo4B-2z2xA:
7.02
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.
2z2z TK-SUBTILISIN
PRECURSOR

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8) 		3 ALA A 163
VAL A 173
TRP A  99
 None
 0.82A 1jo4B-2z2zA:
undetectable		 1jo4B-2z2zA:
3.49
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.
3cmg PUTATIVE
BETA-GALACTOSIDASE

(Bacteroides
fragilis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		3 ALA A 651
VAL A 658
TRP A 659
 None
 0.90A 1jo4B-3cmgA:
undetectable		 1jo4B-3cmgA:
1.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fqd 5'-3'
EXORIBONUCLEASE 2

(Schizosaccharomyces
pombe) 		PF03159
(XRN_N) 		3 ALA A  81
VAL A  60
TRP A 157
 None
 0.87A 1jo4B-3fqdA:
undetectable		 1jo4B-3fqdA:
2.04
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.
3gzg MOLYBDATE-BINDING
PERIPLASMIC PROTEIN
PERMEASE

(Xanthomonas
citri) 		PF13531
(SBP_bac_11) 		3 ALA A 121
VAL A 123
TRP A  62
 SO4  A1403 (-3.9A)
MOO  A1300 (-4.8A)
None
 0.91A 1jo4B-3gzgA:
undetectable		 1jo4B-3gzgA:
4.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m49 TRANSKETOLASE

(Bacillus
anthracis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		3 ALA A 367
VAL A 372
TRP A 342
 GOL  A 705 ( 3.8A)
None
None
 0.81A 1jo4B-3m49A:
undetectable		 1jo4B-3m49A:
2.18
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.
3mnf PAC2 FAMILY PROTEIN

(Streptomyces
avermitilis) 		PF09754
(PAC2) 		3 ALA A  29
VAL A 125
TRP A 186
 None
None
CL  A 301 ( 4.9A)
 0.95A 1jo4B-3mnfA:
undetectable		 1jo4B-3mnfA:
5.81
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.
3ndy ENDOGLUCANASE D

(Clostridium
cellulovorans) 		PF00150
(Cellulase) 		3 ALA A  34
VAL A  66
TRP A  84
 None
 0.95A 1jo4B-3ndyA:
undetectable		 1jo4B-3ndyA:
7.34
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.
3p3l CYTOCHROME P450

(Streptomyces
thioluteus) 		PF00067
(p450) 		3 ALA A 319
VAL A 321
TRP A  26
 None
 0.95A 1jo4B-3p3lA:
undetectable		 1jo4B-3p3lA:
4.64
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.
3qld MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 ALA A 353
VAL A 355
TRP A 358
 None
 0.94A 1jo4B-3qldA:
undetectable		 1jo4B-3qldA:
5.15
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.
3sz3 TRYPTOPHANYL-TRNA
SYNTHETASE

(Vibrio cholerae) 		PF00579
(tRNA-synt_1b) 		3 ALA A  69
VAL A  72
TRP A  28
 None
 0.81A 1jo4B-3sz3A:
undetectable		 1jo4B-3sz3A:
7.84
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.
3tef IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-COMPOUND-BINDIN
G PROTEIN

(Vibrio cholerae) 		PF01497
(Peripla_BP_2) 		3 ALA A 302
VAL A 268
TRP A 309
 None
 0.94A 1jo4B-3tefA:
undetectable		 1jo4B-3tefA:
4.98
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.
3tvt DISKS LARGE 1 TUMOR
SUPPRESSOR PROTEIN

(Drosophila
melanogaster) 		PF00018
(SH3_1)
PF00625
(Guanylate_kin) 		3 ALA A 776
VAL A 969
TRP A 968
 None
 0.93A 1jo4B-3tvtA:
undetectable		 1jo4B-3tvtA:
3.51
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.
3vv3 DESEASIN MCP-01

(Pseudoalteromonas
sp. SM9913) 		PF00082
(Peptidase_S8) 		3 ALA A 114
VAL A 125
TRP A  34
 None
 0.93A 1jo4B-3vv3A:
undetectable		 1jo4B-3vv3A:
4.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zmr CELLULASE (GLYCOSYL
HYDROLASE FAMILY 5)

(Bacteroides
ovatus) 		PF00150
(Cellulase)
PF13004
(BACON) 		3 ALA A 169
VAL A 210
TRP A 228
 None
 0.67A 1jo4B-3zmrA:
undetectable		 1jo4B-3zmrA:
3.50
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.
4bmv SHORT-CHAIN
DEHYDROGENASE

(Sphingobium
yanoikuyae) 		PF00106
(adh_short) 		3 ALA A 184
VAL A 204
TRP A 191
 None
None
NAP  A 300 (-4.0A)
 0.94A 1jo4B-4bmvA:
undetectable		 1jo4B-4bmvA:
8.03
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.
4cpd ALCOHOL
DEHYDROGENASE

(Thermus sp.
ATN1) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 ALA A 147
VAL A  81
TRP A  80
 None
 0.95A 1jo4B-4cpdA:
undetectable		 1jo4B-4cpdA:
4.20
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.
4e1j GLYCEROL KINASE

(Sinorhizobium
meliloti) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 ALA A 122
VAL A 110
TRP A 111
 None
 0.94A 1jo4B-4e1jA:
undetectable		 1jo4B-4e1jA:
2.83
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.
4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		3 ALA A 167
VAL A 138
TRP A 470
 None
 0.95A 1jo4B-4e4gA:
undetectable		 1jo4B-4e4gA:
4.13
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.
4jjj CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Thermobifida
fusca) 		PF02011
(Glyco_hydro_48) 		3 ALA A 622
VAL A 501
TRP A 420
 None
 0.95A 1jo4B-4jjjA:
undetectable		 1jo4B-4jjjA:
2.53
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.
4ly4 PEPTIDOGLYCAN
DEACETYLASE

(Helicobacter
pylori) 		PF01522
(Polysacc_deac_1) 		3 ALA A  57
VAL A 276
TRP A 275
 None
 0.50A 1jo4B-4ly4A:
undetectable		 1jo4B-4ly4A:
5.67
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.
4m3c SEED LECTIN BETA
CHAIN

(Spatholobus
parviflorus) 		PF00139
(Lectin_legB) 		3 ALA F  55
VAL F 208
TRP F 207
 None
 0.88A 1jo4B-4m3cF:
undetectable		 1jo4B-4m3cF:
4.72
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.
4mkv RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Pisum sativum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  15
VAL A  17
TRP A  66
 None
 0.80A 1jo4B-4mkvA:
undetectable		 1jo4B-4mkvA:
3.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mtp RNA DEPENDENT RNA
POLYMERASE

(Japanese
encephalitis
virus) 		PF00972
(Flavi_NS5) 		3 ALA A 628
VAL A 631
TRP A 651
 ALA  A 628 ( 0.0A)
VAL  A 631 ( 0.6A)
TRP  A 651 ( 0.5A)
 0.95A 1jo4B-4mtpA:
undetectable		 1jo4B-4mtpA:
5.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p1c TOLUENE-4-MONOOXYGEN
ASE SYSTEM PROTEIN A

(Pseudomonas
mendocina) 		PF02332
(Phenol_Hydrox) 		3 ALA A 489
VAL A 350
TRP A 336
 None
 0.85A 1jo4B-4p1cA:
undetectable		 1jo4B-4p1cA:
3.33
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.
4pob THIOREDOXIN

(Mycobacteroides
abscessus) 		PF00085
(Thioredoxin) 		3 ALA A  64
VAL A  62
TRP A  30
 None
 0.90A 1jo4B-4pobA:
undetectable		 1jo4B-4pobA:
29.41
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.
4r7y MINICHROMOSOME
MAINTENANCE PROTEIN
MCM, CELL DIVISION
CONTROL PROTEIN 21

(Pyrococcus
furiosus;
Sulfolobus
solfataricus) 		PF00493
(MCM)
PF14551
(MCM_N)
PF17207
(MCM_OB) 		3 ALA A1731
VAL A1742
TRP A1741
 None
 0.87A 1jo4B-4r7yA:
undetectable		 1jo4B-4r7yA:
3.11
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.
4rgq GLYCEROL-1-PHOSPHATE
DEHYDROGENASE

(Methanocaldococcus
jannaschii) 		PF13685
(Fe-ADH_2) 		3 ALA A 221
VAL A 156
TRP A 159
 K  A 402 ( 3.6A)
None
None
 0.74A 1jo4B-4rgqA:
undetectable		 1jo4B-4rgqA:
3.86
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.
4rit PYRIDOXAL-DEPENDENT
DECARBOXYLASE

(Sphaerobacter
thermophilus) 		no annotation 3 ALA B 382
VAL B 453
TRP B 305
 None
 0.88A 1jo4B-4ritB:
undetectable		 1jo4B-4ritB:
3.81
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.
4w87 XYLOGLUCAN-SPECIFIC
ENDO-BETA-1,4-GLUCAN
ASE

(uncultured
bacterium) 		PF00150
(Cellulase) 		3 ALA A 115
VAL A 153
TRP A 171
 None
 0.82A 1jo4B-4w87A:
undetectable		 1jo4B-4w87A:
5.09
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.
4weo PUTATIVE
ACETOIN(DIACETYL)
REDUCTASE

(Burkholderia
cenocepacia) 		PF00106
(adh_short) 		3 ALA A 116
VAL A 111
TRP A 108
 None
 0.89A 1jo4B-4weoA:
undetectable		 1jo4B-4weoA:
7.24
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.
4wq5 TRNA
THREONYLCARBAMOYLADE
NOSINE BIOSYNTHESIS
PROTEIN TSAB

(Escherichia
coli) 		PF00814
(Peptidase_M22) 		3 ALA C 113
VAL C 161
TRP C 160
 None
 0.92A 1jo4B-4wq5C:
undetectable		 1jo4B-4wq5C:
6.05
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.
4xgk UDP-GALACTOPYRANOSE
MUTASE

(Corynebacterium
diphtheriae) 		PF03275
(GLF)
PF13450
(NAD_binding_8) 		3 ALA A  79
VAL A  74
TRP A  71
 None
 0.94A 1jo4B-4xgkA:
undetectable		 1jo4B-4xgkA:
6.07
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.
4xxp PUTATIVE
UNCHARACTERIZED
PROTEIN (RV0315
ORTHOLOG)

(Mycobacterium
avium) 		PF00722
(Glyco_hydro_16) 		3 ALA A 174
VAL A 162
TRP A 200
 None
 0.92A 1jo4B-4xxpA:
undetectable		 1jo4B-4xxpA:
7.64
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.
4yzt CELLULOSE HYDROLASE

(Bacillus
licheniformis) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		3 ALA A  40
VAL A  72
TRP A  90
 None
 0.86A 1jo4B-4yztA:
undetectable		 1jo4B-4yztA:
2.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a3y THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		3 ALA A  73
VAL A  71
TRP A  55
 None
 0.92A 1jo4B-5a3yA:
undetectable		 1jo4B-5a3yA:
4.26
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.
5c59 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB

(Escherichia
coli) 		PF12704
(MacB_PCD) 		3 ALA A  52
VAL A 180
TRP A  48
 None
 0.90A 1jo4B-5c59A:
undetectable		 1jo4B-5c59A:
8.45
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.
5d9n B-1,4-ENDOGLUCANASE

(Prevotella
bryantii) 		PF00150
(Cellulase) 		3 ALA A  32
VAL A  73
TRP A  89
 None
 0.89A 1jo4B-5d9nA:
undetectable		 1jo4B-5d9nA:
7.74
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.
5dac PUTATIVE
UNCHARACTERIZED
PROTEIN,PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		PF13476
(AAA_23) 		3 ALA A 149
VAL A 154
TRP A 164
 None
 0.93A 1jo4B-5dacA:
undetectable		 1jo4B-5dacA:
3.93
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.
5e7l CONTACTIN-2

(Mus musculus) 		PF00041
(fn3) 		3 ALA A 819
VAL A 821
TRP A 822
 None
 0.92A 1jo4B-5e7lA:
undetectable		 1jo4B-5e7lA:
3.38
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.
5fxn THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		3 ALA A  73
VAL A  71
TRP A  55
 None
 0.91A 1jo4B-5fxnA:
undetectable		 1jo4B-5fxnA:
3.87
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.
5ghe PESTICIDAL CRYSTAL
PROTEIN CRY6AA

(Bacillus
thuringiensis) 		no annotation 3 ALA A 113
VAL A 373
TRP A 370
 None
 0.93A 1jo4B-5gheA:
undetectable		 1jo4B-5gheA:
2.75
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.
5gnx BETA-GLUCOSIDASE

(metagenome) 		PF00232
(Glyco_hydro_1) 		3 ALA A 198
VAL A 196
TRP A 253
 None
 0.96A 1jo4B-5gnxA:
undetectable		 1jo4B-5gnxA:
4.20
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.
5h4r BETA-1,3-1,4-GLUCANA
SE

(Caldicellulosiruptor
sp. F32) 		PF00150
(Cellulase) 		3 ALA A  59
VAL A 101
TRP A 118
 None
 0.87A 1jo4B-5h4rA:
undetectable		 1jo4B-5h4rA:
3.89
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.
5h98 GEOBACTER
METALLIREDUCENS
SMUG1

(Geobacter
metallireducens) 		no annotation 3 ALA A 135
VAL A  69
TRP A 115
 None
 0.88A 1jo4B-5h98A:
undetectable		 1jo4B-5h98A:
5.75
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.
5kdx METALLOPEPTIDASE

(Pseudomonas
aeruginosa) 		PF13402
(Peptidase_M60) 		3 ALA A 670
VAL A 666
TRP A 685
 None
 0.77A 1jo4B-5kdxA:
undetectable		 1jo4B-5kdxA:
1.73
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.
5lj8 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB

(Escherichia
coli) 		no annotation 3 ALA A 348
VAL A 476
TRP A 344
 None
 0.93A 1jo4B-5lj8A:
undetectable		 1jo4B-5lj8A:
8.45
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.
5nf4 MINOR FIMBRIUM TIP
SUBUNIT MFA3

(Porphyromonas
gingivalis) 		no annotation 3 ALA A 240
VAL A 238
TRP A 244
 None
 0.86A 1jo4B-5nf4A:
undetectable		 1jo4B-5nf4A:
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.
5nv3 RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Rhodobacter
sphaeroides) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  16
VAL A  18
TRP A  68
 None
 0.93A 1jo4B-5nv3A:
undetectable		 1jo4B-5nv3A:
4.20
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.
5oms CYTOCHROME P450

(Amycolatopsis
sp. ATCC 39116) 		no annotation 3 ALA A 297
VAL A  47
TRP A 393
 None
 0.92A 1jo4B-5omsA:
undetectable		 1jo4B-5omsA:
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.
5oyd CELLULASE, PUTATIVE,
CEL5D

(Cellvibrio
japonicus) 		no annotation 3 ALA A 136
VAL A 168
TRP A 185
 None
 0.68A 1jo4B-5oydA:
undetectable		 1jo4B-5oydA:
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.
5tdg FUSION GLYCOPROTEIN
F0,FIBRITIN

(Bovine
orthopneumovirus;
Enterobacteria
phage T4 sensu
lato) 		PF00523
(Fusion_gly)
PF07921
(Fibritin_C) 		3 ALA A 529
VAL A 538
TRP A 537
 None
 0.81A 1jo4B-5tdgA:
undetectable		 1jo4B-5tdgA:
4.71
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.
5tkf LYTIC POLYSACCHARIDE
MONOOXYGENASE

(Neurospora
crassa) 		PF03443
(Glyco_hydro_61) 		3 ALA A 101
VAL A 104
TRP A 108
 None
 0.93A 1jo4B-5tkfA:
undetectable		 1jo4B-5tkfA:
7.14
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.
5ubk ACYL-HOMOSERINE
LACTONE ACYLASE PVDQ

(Pseudomonas
aeruginosa) 		PF01804
(Penicil_amidase) 		3 ALA A 147
VAL A 133
TRP A 140
 None
 0.87A 1jo4B-5ubkA:
undetectable		 1jo4B-5ubkA:
3.34
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.
5v2m MEVALONATE
DIPHOSPHATE
DECARBOXYLASE

(Enterococcus
faecalis) 		no annotation 3 ALA A 249
VAL A 199
TRP A  18
 None
 0.64A 1jo4B-5v2mA:
undetectable		 1jo4B-5v2mA:
4.23
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.
5wsl KERATINASE

(Meiothermus
taiwanensis) 		no annotation 3 ALA A  55
VAL A  96
TRP A 116
 None
 0.94A 1jo4B-5wslA:
undetectable		 1jo4B-5wslA:
5.61
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.
5xd0 GLUCANASE

(Paenibacillus
sp. X4) 		PF01270
(Glyco_hydro_8) 		3 ALA A 238
VAL A 243
TRP A 201
 None
 0.92A 1jo4B-5xd0A:
undetectable		 1jo4B-5xd0A:
3.01
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.
5y7l -

(-) 		no annotation 3 ALA A  98
VAL A  87
TRP A 133
 None
 0.90A 1jo4B-5y7lA:
undetectable		 1jo4B-5y7lA:
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.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 3 ALA A  80
VAL A  71
TRP A  82
 None
 0.95A 1jo4B-6c7sA:
undetectable		 1jo4B-6c7sA:
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.
6df3 -

(-) 		no annotation 3 ALA C 166
VAL C  96
TRP C 199
 None
 0.94A 1jo4B-6df3C:
undetectable		 1jo4B-6df3C:
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.
6f0q PIZZA6-AYW

(synthetic
construct) 		no annotation 3 ALA A  82
VAL A  68
TRP A  69
 None
 0.96A 1jo4B-6f0qA:
undetectable		 1jo4B-6f0qA:
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.
6f0q PIZZA6-AYW

(synthetic
construct) 		no annotation 3 ALA A 125
VAL A 110
TRP A 111
 None
 0.94A 1jo4B-6f0qA:
undetectable		 1jo4B-6f0qA:
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.
6f9m SERINE PROTEASE

(Planococcus
plakortidis) 		no annotation 3 ALA A  96
VAL A 107
TRP A  34
 NA  A 402 ( 4.7A)
None
None
 0.88A 1jo4B-6f9mA:
undetectable		 1jo4B-6f9mA:
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.
6fbt LYTIC MUREIN
TRANSGLYCOSYLASE

(Pseudomonas
aeruginosa) 		no annotation 3 ALA A 188
VAL A 155
TRP A 153
 None
 0.78A 1jo4B-6fbtA:
undetectable		 1jo4B-6fbtA:
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.
6fhs INO80

(Chaetomium
thermophilum) 		no annotation 3 ALA G1420
VAL G1418
TRP G1415
 None
 0.93A 1jo4B-6fhsG:
undetectable		 1jo4B-6fhsG:
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.
6fml INO80

(Chaetomium
thermophilum) 		no annotation 3 ALA G1420
VAL G1418
TRP G1415
 None
 0.94A 1jo4B-6fmlG:
undetectable		 1jo4B-6fmlG:
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.
6gdr -

(-) 		no annotation 3 ALA A 216
VAL A 268
TRP A 267
 None
 0.92A 1jo4B-6gdrA:
undetectable		 1jo4B-6gdrA:
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.
6req PROTEIN
(METHYLMALONYL-COA
MUTASE)

(Propionibacterium
freudenreichii) 		PF01642
(MM_CoA_mutase) 		3 ALA B 538
VAL B 534
TRP B 535
 None
 0.83A 1jo4B-6reqB:
undetectable		 1jo4B-6reqB:
4.68