SIMILAR PATTERNS OF AMINO ACIDS FOR 5X80_C_SALC201

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.
1al8 GLYCOLATE OXIDASE

(Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 VAL A 288
ARG A 289
VAL A 326
PRO A 310
GLY A 308
 None
FMN  A 360 (-2.9A)
None
None
FMN  A 360 (-3.5A)
 1.19A 5x80C-1al8A:
undetectable
5x80D-1al8A:
0.0		 5x80C-1al8A:
22.28
5x80D-1al8A:
22.28
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.
1bkb TRANSLATION
INITIATION FACTOR 5A

(Pyrobaculum
aerophilum) 		PF01287
(eIF-5a)
PF08207
(EFP_N) 		4 VAL A  33
ARG A  31
VAL A  23
GLY A  54
 None
 0.97A 5x80C-1bkbA:
undetectable
5x80D-1bkbA:
undetectable		 5x80C-1bkbA:
20.12
5x80D-1bkbA:
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.
1ek6 UDP-GALACTOSE
4-EPIMERASE

(Homo sapiens) 		PF16363
(GDP_Man_Dehyd) 		4 VAL A 304
PRO A 139
GLY A 137
TYR A 136
 None
 1.01A 5x80C-1ek6A:
0.0
5x80D-1ek6A:
undetectable		 5x80C-1ek6A:
19.53
5x80D-1ek6A:
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.
1em8 DNA POLYMERASE III
CHI SUBUNIT
DNA POLYMERASE III
PSI SUBUNIT

(Escherichia
coli) 		PF03603
(DNA_III_psi)
PF04364
(DNA_pol3_chi) 		4 ARG B  59
ARG A  32
VAL A  39
GLY A  36
 None
 0.90A 5x80C-1em8B:
undetectable
5x80D-1em8B:
undetectable		 5x80C-1em8B:
28.48
5x80D-1em8B:
28.48
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.
1em9 GAG POLYPROTEIN
CAPSID PROTEIN P27

(Rous sarcoma
virus) 		no annotation 4 VAL A 143
VAL A  26
GLY A  62
TYR A  66
 None
 0.97A 5x80C-1em9A:
2.4
5x80D-1em9A:
2.3		 5x80C-1em9A:
24.55
5x80D-1em9A:
24.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fc4 2-AMINO-3-KETOBUTYRA
TE CONENZYME A
LIGASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		4 VAL A 183
VAL A 209
GLY A 224
TYR A 228
 None
 0.99A 5x80C-1fc4A:
0.0
5x80D-1fc4A:
0.0		 5x80C-1fc4A:
18.25
5x80D-1fc4A:
18.25
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.
1fn4 MONOCLONAL ANTIBODY
AGAINST
ACETYLCHOLINE
RECEPTOR

(Rattus
norvegicus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL B  34
PRO B 100
GLY B 100
TYR B 100
 None
 1.00A 5x80C-1fn4B:
undetectable
5x80D-1fn4B:
undetectable		 5x80C-1fn4B:
19.82
5x80D-1fn4B:
19.82
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.
1fp3 N-ACYL-D-GLUCOSAMINE
2-EPIMERASE

(Sus scrofa) 		PF07221
(GlcNAc_2-epim) 		4 ARG A 351
ARG A  44
GLY A 356
TYR A 355
 None
 0.99A 5x80C-1fp3A:
0.8
5x80D-1fp3A:
0.8		 5x80C-1fp3A:
17.50
5x80D-1fp3A:
17.50
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.
1ga7 HYPOTHETICAL 23.7
KDA PROTEIN IN
ICC-TOLC INTERGENIC
REGION

(Escherichia
coli) 		PF00293
(NUDIX) 		4 ARG A 110
VAL A  95
PRO A  64
GLY A 146
 None
 0.83A 5x80C-1ga7A:
0.0
5x80D-1ga7A:
0.0		 5x80C-1ga7A:
23.26
5x80D-1ga7A:
23.26
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.
1i31 CLATHRIN COAT
ASSEMBLY PROTEIN
AP50

(Rattus
norvegicus) 		PF00928
(Adap_comp_sub) 		4 VAL A 177
VAL A 196
PRO A 396
GLY A 398
 None
 0.98A 5x80C-1i31A:
undetectable
5x80D-1i31A:
undetectable		 5x80C-1i31A:
19.39
5x80D-1i31A:
19.39
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.
1id5 THROMBIN

(Bos taurus) 		PF00089
(Trypsin) 		4 VAL H 200
VAL H 231
PRO H 124
TYR H 208
 None
 0.97A 5x80C-1id5H:
0.0
5x80D-1id5H:
0.0		 5x80C-1id5H:
18.77
5x80D-1id5H:
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.
1jbk CLPB PROTEIN

(Escherichia
coli) 		PF00004
(AAA) 		4 VAL A 216
VAL A 336
PRO A 202
GLY A 312
 None
 0.95A 5x80C-1jbkA:
0.0
5x80D-1jbkA:
0.2		 5x80C-1jbkA:
19.00
5x80D-1jbkA:
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.
1jzo THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBC

(Escherichia
coli) 		PF10411
(DsbC_N)
PF13098
(Thioredoxin_2) 		4 VAL A  92
PRO A 183
GLY A 195
TYR A 100
 None
 1.02A 5x80C-1jzoA:
undetectable
5x80D-1jzoA:
undetectable		 5x80C-1jzoA:
23.87
5x80D-1jzoA:
23.87
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.
1kwg BETA-GALACTOSIDASE

(Thermus
thermophilus) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		4 ARG A 333
PRO A 329
GLY A 330
TYR A 637
 None
 1.00A 5x80C-1kwgA:
undetectable
5x80D-1kwgA:
undetectable		 5x80C-1kwgA:
13.78
5x80D-1kwgA:
13.78
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.
1l2q MONOMETHYLAMINE
METHYLTRANSFERASE

(Methanosarcina
barkeri) 		PF05369
(MtmB) 		4 ARG A 361
VAL A 118
PRO A  53
GLY A 316
 None
 1.00A 5x80C-1l2qA:
undetectable
5x80D-1l2qA:
0.4		 5x80C-1l2qA:
15.97
5x80D-1l2qA:
15.97
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.
1ltd FLAVOCYTOCHROME B2

(Saccharomyces
cerevisiae) 		PF00173
(Cyt-b5)
PF01070
(FMN_dh) 		4 VAL A 412
ARG A 413
PRO A 434
GLY A 432
 None
FMN  A 570 (-3.9A)
None
FMN  A 570 (-3.8A)
 0.99A 5x80C-1ltdA:
undetectable
5x80D-1ltdA:
undetectable		 5x80C-1ltdA:
16.85
5x80D-1ltdA:
16.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nl3 PREPROTEIN
TRANSLOCASE SECA 1
SUBUNIT

(Mycobacterium
tuberculosis) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		4 VAL A 474
VAL A 544
PRO A 432
GLY A 479
 None
 1.00A 5x80C-1nl3A:
1.5
5x80D-1nl3A:
1.4		 5x80C-1nl3A:
11.22
5x80D-1nl3A:
11.22
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.
1qcw FLAVOCYTOCHROME B2

(Saccharomyces
cerevisiae) 		PF01070
(FMN_dh) 		4 VAL A 412
ARG A 413
PRO A 434
GLY A 432
 None
FNS  A 570 (-3.3A)
None
FNS  A 570 (-3.4A)
 1.01A 5x80C-1qcwA:
undetectable
5x80D-1qcwA:
0.5		 5x80C-1qcwA:
17.75
5x80D-1qcwA:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qqf PROTEIN (COMPLEMENT
C3DG)

(Rattus
norvegicus) 		PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		4 VAL A1082
VAL A1022
GLY A1052
TYR A1053
 None
 1.02A 5x80C-1qqfA:
undetectable
5x80D-1qqfA:
undetectable		 5x80C-1qqfA:
20.21
5x80D-1qqfA:
20.21
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.
1qvr CLPB PROTEIN

(Thermus
thermophilus) 		PF00004
(AAA)
PF02861
(Clp_N)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		4 VAL A 208
VAL A 327
PRO A 194
GLY A 304
 None
 0.93A 5x80C-1qvrA:
undetectable
5x80D-1qvrA:
undetectable		 5x80C-1qvrA:
12.12
5x80D-1qvrA:
12.12
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.
1tkc TRANSKETOLASE

(Saccharomyces
cerevisiae) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ARG A  16
VAL A  20
GLY A 251
TYR A 252
 None
 0.92A 5x80C-1tkcA:
undetectable
5x80D-1tkcA:
undetectable		 5x80C-1tkcA:
13.22
5x80D-1tkcA:
13.22
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.
1v6c ALKALINE SERINE
PROTEASE

(Pseudoalteromonas
sp. AS-11) 		PF00082
(Peptidase_S8)
PF02225
(PA) 		4 VAL A 196
VAL A 375
GLY A 417
TYR A 416
 None
 0.95A 5x80C-1v6cA:
undetectable
5x80D-1v6cA:
undetectable		 5x80C-1v6cA:
16.55
5x80D-1v6cA:
16.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zz3 HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE

(Alcaligenaceae
bacterium FB188) 		PF00850
(Hist_deacetyl) 		4 ARG A 124
VAL A 305
GLY A   4
TYR A   5
 None
 0.82A 5x80C-1zz3A:
undetectable
5x80D-1zz3A:
undetectable		 5x80C-1zz3A:
19.62
5x80D-1zz3A:
19.62
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.
2au3 DNA PRIMASE

(Aquifex
aeolicus) 		PF01807
(zf-CHC2)
PF08275
(Toprim_N)
PF13155
(Toprim_2) 		4 VAL A 110
VAL A 188
PRO A 190
GLY A 200
 None
 0.91A 5x80C-2au3A:
undetectable
5x80D-2au3A:
undetectable		 5x80C-2au3A:
17.57
5x80D-2au3A:
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.
2d4v ISOCITRATE
DEHYDROGENASE

(Acidithiobacillus
thiooxidans) 		PF00180
(Iso_dh) 		4 ARG A 410
VAL A 402
PRO A 138
GLY A 136
 None
 0.99A 5x80C-2d4vA:
1.4
5x80D-2d4vA:
1.4		 5x80C-2d4vA:
17.22
5x80D-2d4vA:
17.22
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.
2dvz PUTATIVE EXPORTED
PROTEIN

(Bordetella
pertussis) 		PF03401
(TctC) 		4 VAL A  40
VAL A  23
GLY A 244
TYR A 243
 None
None
None
GLU  A1055 (-4.2A)
 0.89A 5x80C-2dvzA:
undetectable
5x80D-2dvzA:
undetectable		 5x80C-2dvzA:
21.38
5x80D-2dvzA:
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.
2g2o MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Escherichia
coli) 		PF00698
(Acyl_transf_1) 		4 VAL A 100
VAL A 228
GLY A  94
TYR A  96
 None
 1.01A 5x80C-2g2oA:
undetectable
5x80D-2g2oA:
undetectable		 5x80C-2g2oA:
22.88
5x80D-2g2oA:
22.88
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.
2gsj PROTEIN PPL-2

(Parkia
platycephala) 		PF00704
(Glyco_hydro_18) 		4 ARG A  70
ARG A 255
VAL A  28
GLY A  23
 SO4  A1001 (-2.3A)
None
None
None
 0.87A 5x80C-2gsjA:
undetectable
5x80D-2gsjA:
undetectable		 5x80C-2gsjA:
21.48
5x80D-2gsjA:
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.
2iie INTEGRATION HOST
FACTOR

(Escherichia
coli) 		PF00216
(Bac_DNA_binding) 		5 ARG A  79
ARG A 188
VAL A 123
PRO A 183
GLY A 150
 None
 1.28A 5x80C-2iieA:
1.2
5x80D-2iieA:
1.8		 5x80C-2iieA:
22.60
5x80D-2iieA:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oq5 TRANSMEMBRANE
PROTEASE, SERINE 11E

(Homo sapiens) 		PF00089
(Trypsin) 		4 VAL A 200
VAL A 231
PRO A 124
TYR A 208
 None
 0.95A 5x80C-2oq5A:
undetectable
5x80D-2oq5A:
undetectable		 5x80C-2oq5A:
22.13
5x80D-2oq5A:
22.13
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.
2pok PEPTIDASE,
M20/M25/M40 FAMILY

(Streptococcus
pneumoniae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 VAL A  45
VAL A  71
PRO A  69
GLY A 155
 None
 0.85A 5x80C-2pokA:
undetectable
5x80D-2pokA:
undetectable		 5x80C-2pokA:
20.40
5x80D-2pokA:
20.40
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.
2qe6 UNCHARACTERIZED
PROTEIN TFU_2867

(Thermobifida
fusca) 		PF04672
(Methyltransf_19) 		4 VAL A 240
VAL A  63
GLY A 264
TYR A 242
 None
None
MPD  A 401 (-3.2A)
SO4  A 276 (-4.6A)
 0.98A 5x80C-2qe6A:
undetectable
5x80D-2qe6A:
undetectable		 5x80C-2qe6A:
21.51
5x80D-2qe6A:
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.
2vc6 DIHYDRODIPICOLINATE
SYNTHASE

(Sinorhizobium
meliloti) 		PF00701
(DHDPS) 		4 VAL A 209
VAL A  10
GLY A 251
TYR A 254
 None
 0.91A 5x80C-2vc6A:
undetectable
5x80D-2vc6A:
undetectable		 5x80C-2vc6A:
19.80
5x80D-2vc6A:
19.80
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.
2vgi PYRUVATE KINASE
ISOZYMES R/L

(Homo sapiens) 		PF00224
(PK)
PF02887
(PK_C) 		4 ARG A 518
PRO A 145
GLY A 143
TYR A 148
 None
 0.94A 5x80C-2vgiA:
undetectable
5x80D-2vgiA:
undetectable		 5x80C-2vgiA:
16.63
5x80D-2vgiA:
16.63
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.
2vn8 RETICULON-4-INTERACT
ING PROTEIN 1

(Homo sapiens) 		PF08240
(ADH_N)
PF13602
(ADH_zinc_N_2) 		4 ARG A 388
VAL A 244
VAL A 365
GLY A 215
 NDP  A 600 (-2.9A)
None
None
NDP  A 600 (-3.2A)
 0.76A 5x80C-2vn8A:
undetectable
5x80D-2vn8A:
undetectable		 5x80C-2vn8A:
20.32
5x80D-2vn8A:
20.32
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.
2xqw COMPLEMENT C3

(Homo sapiens) 		PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		4 VAL A  89
VAL A  29
GLY A  59
TYR A  60
 None
 1.00A 5x80C-2xqwA:
0.6
5x80D-2xqwA:
0.7		 5x80C-2xqwA:
20.61
5x80D-2xqwA:
20.61
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.
3abz BETA-GLUCOSIDASE I

(Kluyveromyces
marxianus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF07691
(PA14)
PF14310
(Fn3-like) 		4 VAL A 322
VAL A 755
GLY A 715
TYR A 716
 None
None
None
GOL  A5003 (-4.3A)
 0.99A 5x80C-3abzA:
undetectable
5x80D-3abzA:
undetectable		 5x80C-3abzA:
11.74
5x80D-3abzA:
11.74
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.
3al0 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Thermotoga
maritima) 		PF01425
(Amidase) 		4 VAL A 207
PRO A 202
GLY A 177
TYR A 178
 None
 0.84A 5x80C-3al0A:
undetectable
5x80D-3al0A:
undetectable		 5x80C-3al0A:
16.45
5x80D-3al0A:
16.45
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.
3d02 PUTATIVE LACI-TYPE
TRANSCRIPTIONAL
REGULATOR

(Klebsiella
pneumoniae) 		PF13407
(Peripla_BP_4) 		4 VAL A 279
VAL A  31
GLY A 273
TYR A 274
 None
 0.99A 5x80C-3d02A:
undetectable
5x80D-3d02A:
undetectable		 5x80C-3d02A:
22.34
5x80D-3d02A:
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.
3enk UDP-GLUCOSE
4-EPIMERASE

(Burkholderia
pseudomallei) 		PF16363
(GDP_Man_Dehyd) 		4 VAL A 299
PRO A 135
GLY A 133
TYR A 132
 None
 0.98A 5x80C-3enkA:
undetectable
5x80D-3enkA:
undetectable		 5x80C-3enkA:
20.17
5x80D-3enkA:
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.
3epm THIAMINE
BIOSYNTHESIS PROTEIN
THIC

(Caulobacter
vibrioides) 		PF01964
(ThiC_Rad_SAM)
PF13667
(ThiC-associated) 		4 VAL A 237
VAL A 269
PRO A  58
GLY A  60
 None
 1.01A 5x80C-3epmA:
undetectable
5x80D-3epmA:
undetectable		 5x80C-3epmA:
14.66
5x80D-3epmA:
14.66
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.
3gkf ALDOLASE LSRF

(Escherichia
coli) 		no annotation 4 VAL O 131
ARG O  39
VAL O 138
GLY O 163
 None
 1.01A 5x80C-3gkfO:
undetectable
5x80D-3gkfO:
undetectable		 5x80C-3gkfO:
19.73
5x80D-3gkfO:
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.
3im8 MALONYL ACYL CARRIER
PROTEIN TRANSACYLASE

(Streptococcus
pneumoniae) 		PF00698
(Acyl_transf_1) 		4 VAL A  98
VAL A  86
GLY A  92
TYR A  94
 None
 1.02A 5x80C-3im8A:
undetectable
5x80D-3im8A:
undetectable		 5x80C-3im8A:
20.95
5x80D-3im8A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ix0 BETA-MICROSEMINOPROT
EIN

(Homo sapiens) 		PF05825
(PSP94) 		4 ARG A  66
VAL A  77
PRO A  56
GLY A  58
 None
 0.89A 5x80C-3ix0A:
undetectable
5x80D-3ix0A:
undetectable		 5x80C-3ix0A:
15.24
5x80D-3ix0A:
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.
3k40 AROMATIC-L-AMINO-ACI
D DECARBOXYLASE

(Drosophila
melanogaster) 		PF00282
(Pyridoxal_deC) 		4 VAL A 240
VAL A 209
GLY A 218
TYR A 252
 None
 0.89A 5x80C-3k40A:
1.5
5x80D-3k40A:
undetectable		 5x80C-3k40A:
15.32
5x80D-3k40A:
15.32
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.
3no4 CREATININE
AMIDOHYDROLASE

(Nostoc
punctiforme) 		PF02633
(Creatininase) 		4 VAL A 193
PRO A 210
GLY A 212
TYR A 209
 None
 0.85A 5x80C-3no4A:
undetectable
5x80D-3no4A:
undetectable		 5x80C-3no4A:
25.18
5x80D-3no4A:
25.18
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.
3nxp PRETHROMBIN-1

(Homo sapiens) 		PF00051
(Kringle)
PF00089
(Trypsin)
PF09396
(Thrombin_light) 		4 VAL A 600
VAL A 631
PRO A 524
TYR A 608
 None
 1.00A 5x80C-3nxpA:
undetectable
5x80D-3nxpA:
undetectable		 5x80C-3nxpA:
16.67
5x80D-3nxpA:
16.67
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.
3qr3 ENDOGLUCANASE EG-II

(Trichoderma
reesei) 		PF00150
(Cellulase) 		4 VAL A 161
VAL A 152
PRO A 149
GLY A 182
 None
 0.91A 5x80C-3qr3A:
undetectable
5x80D-3qr3A:
undetectable		 5x80C-3qr3A:
17.47
5x80D-3qr3A:
17.47
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.
3rim TRANSKETOLASE

(Mycobacterium
tuberculosis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ARG A  31
VAL A 295
PRO A 272
GLY A 270
 None
 0.98A 5x80C-3rimA:
undetectable
5x80D-3rimA:
undetectable		 5x80C-3rimA:
14.61
5x80D-3rimA:
14.61
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.
3rp7 FLAVOPROTEIN
MONOOXYGENASE

(Klebsiella
pneumoniae) 		PF01494
(FAD_binding_3) 		4 ARG A 116
VAL A  28
GLY A 115
TYR A 113
 None
 1.00A 5x80C-3rp7A:
undetectable
5x80D-3rp7A:
undetectable		 5x80C-3rp7A:
22.36
5x80D-3rp7A:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sgz HYDROXYACID OXIDASE
2

(Rattus
norvegicus) 		PF01070
(FMN_dh) 		5 VAL A 281
ARG A 282
VAL A 319
PRO A 303
GLY A 301
 None
FMN  A 401 (-2.9A)
None
FMN  A 401 (-4.8A)
FMN  A 401 (-3.4A)
 1.31A 5x80C-3sgzA:
undetectable
5x80D-3sgzA:
undetectable		 5x80C-3sgzA:
18.77
5x80D-3sgzA:
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.
3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE

(Coxiella
burnetii) 		PF00155
(Aminotran_1_2) 		4 VAL A 181
VAL A 207
GLY A 222
TYR A 226
 None
 0.94A 5x80C-3tqxA:
0.8
5x80D-3tqxA:
undetectable		 5x80C-3tqxA:
18.32
5x80D-3tqxA:
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.
3u4a JMB19063

(compost
metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 VAL A 366
VAL A 657
GLY A 614
TYR A 615
 None
 0.97A 5x80C-3u4aA:
undetectable
5x80D-3u4aA:
undetectable		 5x80C-3u4aA:
12.96
5x80D-3u4aA:
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.
3u9r METHYLCROTONYL-COA
CARBOXYLASE,
BETA-SUBUNIT

(Pseudomonas
aeruginosa) 		PF01039
(Carboxyl_trans) 		4 ARG B 525
ARG B 180
PRO B 147
TYR B 146
 None
 0.97A 5x80C-3u9rB:
undetectable
5x80D-3u9rB:
undetectable		 5x80C-3u9rB:
19.27
5x80D-3u9rB:
19.27
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.
3ue3 SEPTUM FORMATION,
PENICILLIN BINDING
PROTEIN 3,
PEPTIDOGLYCAN
SYNTHETASE

(Acinetobacter
sp. ATCC 27244) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 VAL A 393
VAL A 358
GLY A 379
TYR A 378
 None
 0.96A 5x80C-3ue3A:
undetectable
5x80D-3ue3A:
undetectable		 5x80C-3ue3A:
18.35
5x80D-3ue3A:
18.35
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.
3v75 OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Streptomyces
avermitilis) 		PF00215
(OMPdecase) 		5 VAL A 175
VAL A 152
PRO A 129
GLY A 132
TYR A 130
 None
 1.43A 5x80C-3v75A:
undetectable
5x80D-3v75A:
undetectable		 5x80C-3v75A:
25.83
5x80D-3v75A:
25.83
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.
3va7 KLLA0E08119P

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 ARG A1198
VAL A1082
PRO A1121
GLY A1188
 None
 0.99A 5x80C-3va7A:
undetectable
5x80D-3va7A:
undetectable		 5x80C-3va7A:
10.30
5x80D-3va7A:
10.30
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.
3vpx LEUCINE
DEHYDROGENASE

(Sporosarcina
psychrophila) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		4 VAL A 310
VAL A 316
GLY A 157
TYR A 156
 None
 0.95A 5x80C-3vpxA:
undetectable
5x80D-3vpxA:
undetectable		 5x80C-3vpxA:
17.96
5x80D-3vpxA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wad GLYCOSYLTRANSFERASE

(Streptomyces
halstedii) 		PF06722
(DUF1205) 		4 VAL A 349
VAL A 361
PRO A 340
GLY A 321
 None
 0.90A 5x80C-3wadA:
undetectable
5x80D-3wadA:
undetectable		 5x80C-3wadA:
18.03
5x80D-3wadA:
18.03
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.
4a7p UDP-GLUCOSE
DEHYDROGENASE

(Sphingomonas
elodea) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		4 VAL A 387
ARG A 414
VAL A 432
GLY A 259
 None
 0.94A 5x80C-4a7pA:
undetectable
5x80D-4a7pA:
undetectable		 5x80C-4a7pA:
20.40
5x80D-4a7pA:
20.40
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.
4atw ALPHA-L-ARABINOFURAN
OSIDASE DOMAIN
PROTEIN

(Thermotoga
maritima) 		PF06964
(Alpha-L-AF_C) 		4 VAL A 454
PRO A 345
GLY A 302
TYR A 297
 None
 1.00A 5x80C-4atwA:
undetectable
5x80D-4atwA:
undetectable		 5x80C-4atwA:
14.08
5x80D-4atwA:
14.08
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.
4av6 K(+)-STIMULATED
PYROPHOSPHATE-ENERGI
ZED SODIUM PUMP

(Thermotoga
maritima) 		PF03030
(H_PPase) 		4 VAL A 192
PRO A 614
GLY A 612
TYR A 613
 None
 0.92A 5x80C-4av6A:
1.2
5x80D-4av6A:
undetectable		 5x80C-4av6A:
14.20
5x80D-4av6A:
14.20
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.
4chb KELCH-LIKE PROTEIN 2

(Homo sapiens) 		PF01344
(Kelch_1) 		4 VAL A 452
VAL A 405
GLY A 443
TYR A 450
 None
 0.89A 5x80C-4chbA:
undetectable
5x80D-4chbA:
undetectable		 5x80C-4chbA:
21.51
5x80D-4chbA:
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.
4ciu CHAPERONE PROTEIN
CLPB

(Escherichia
coli) 		PF00004
(AAA)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		4 VAL A 216
VAL A 336
PRO A 202
GLY A 312
 None
 0.88A 5x80C-4ciuA:
2.3
5x80D-4ciuA:
1.5		 5x80C-4ciuA:
14.69
5x80D-4ciuA:
14.69
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.
4dqk BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE

(Bacillus
megaterium) 		PF00175
(NAD_binding_1)
PF00667
(FAD_binding_1) 		4 VAL A 979
VAL A 902
GLY A 936
TYR A 975
 None
None
None
SO4  A1103 (-4.7A)
 0.98A 5x80C-4dqkA:
undetectable
5x80D-4dqkA:
undetectable		 5x80C-4dqkA:
19.08
5x80D-4dqkA:
19.08
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.
4e1t INVASIN

(Yersinia
pseudotuberculosis) 		PF11924
(IAT_beta) 		4 VAL A 386
ARG A 229
GLY A 270
TYR A 248
 None
 0.97A 5x80C-4e1tA:
undetectable
5x80D-4e1tA:
undetectable		 5x80C-4e1tA:
19.03
5x80D-4e1tA:
19.03
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.
4fnq ALPHA-GALACTOSIDASE
AGAB

(Geobacillus
stearothermophilus) 		PF02065
(Melibiase)
PF16874
(Glyco_hydro_36C)
PF16875
(Glyco_hydro_36N) 		4 VAL A 271
VAL A 295
GLY A 248
TYR A 247
 None
 0.92A 5x80C-4fnqA:
undetectable
5x80D-4fnqA:
undetectable		 5x80C-4fnqA:
12.95
5x80D-4fnqA:
12.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fw1 INTEGRASE

(Rous sarcoma
virus) 		PF00552
(IN_DBD_C)
PF00665
(rve) 		4 ARG A  53
VAL A 241
VAL A 257
GLY A  54
 None
 1.00A 5x80C-4fw1A:
undetectable
5x80D-4fw1A:
undetectable		 5x80C-4fw1A:
21.43
5x80D-4fw1A:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hse CHAPERONE PROTEIN
CLPB

(Thermus
thermophilus) 		PF00004
(AAA) 		4 VAL A 208
VAL A 327
PRO A 194
GLY A 304
 None
 0.97A 5x80C-4hseA:
2.2
5x80D-4hseA:
2.0		 5x80C-4hseA:
19.07
5x80D-4hseA:
19.07
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.
4hst GLUTARYL-7-AMINOCEPH
ALOSPORANIC ACID
ACYLASE BETA CHAIN

(Pseudomonas) 		PF01804
(Penicil_amidase) 		4 ARG B  88
VAL B 119
PRO B 131
GLY B  87
 None
 0.96A 5x80C-4hstB:
undetectable
5x80D-4hstB:
undetectable		 5x80C-4hstB:
15.10
5x80D-4hstB:
15.10
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.
4hzh PROTHROMBIN

(Homo sapiens) 		PF00051
(Kringle)
PF00089
(Trypsin)
PF09396
(Thrombin_light) 		4 VAL A 530
VAL A 563
PRO A 441
TYR A 540
 None
 0.98A 5x80C-4hzhA:
undetectable
5x80D-4hzhA:
undetectable		 5x80C-4hzhA:
16.98
5x80D-4hzhA:
16.98
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.
4iug BETA-GALACTOSIDASE A

(Aspergillus
oryzae) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 VAL A 319
PRO A 261
GLY A 263
TYR A 260
 None
None
None
GAL  A1130 (-4.5A)
 1.01A 5x80C-4iugA:
undetectable
5x80D-4iugA:
undetectable		 5x80C-4iugA:
10.46
5x80D-4iugA:
10.46
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.
4nff KALLIKREIN-2

(Homo sapiens) 		PF00089
(Trypsin) 		4 VAL A 200
VAL A 231
PRO A 124
GLY A 122
 None
 1.01A 5x80C-4nffA:
undetectable
5x80D-4nffA:
undetectable		 5x80C-4nffA:
22.92
5x80D-4nffA:
22.92
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.
4pgz MAST/STEM CELL
GROWTH FACTOR
RECEPTOR KIT

(Homo sapiens) 		no annotation 4 VAL C 409
VAL C 497
PRO C 434
GLY C 432
 None
 0.96A 5x80C-4pgzC:
undetectable
5x80D-4pgzC:
undetectable		 5x80C-4pgzC:
20.55
5x80D-4pgzC:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ui9 CELL DIVISION CYCLE
PROTEIN 23 HOMOLOG

(Homo sapiens) 		PF04049
(ANAPC8)
PF13181
(TPR_8)
PF13414
(TPR_11) 		4 VAL C 191
VAL C 198
GLY C 171
TYR C 173
 None
 0.86A 5x80C-4ui9C:
undetectable
5x80D-4ui9C:
undetectable		 5x80C-4ui9C:
13.90
5x80D-4ui9C:
13.90
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.
4w8b EXO-XYLOGLUCANASE

(uncultured
bacterium) 		PF00150
(Cellulase) 		4 VAL A 184
VAL A 505
PRO A 150
GLY A 151
 None
 0.99A 5x80C-4w8bA:
undetectable
5x80D-4w8bA:
undetectable		 5x80C-4w8bA:
16.05
5x80D-4w8bA:
16.05
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.
4wzb NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		5 ARG A  96
VAL A 110
PRO A  74
GLY A 255
TYR A 229
 ICS  A1496 (-4.0A)
None
None
None
ICS  A1496 (-4.1A)
 1.24A 5x80C-4wzbA:
undetectable
5x80D-4wzbA:
undetectable		 5x80C-4wzbA:
17.04
5x80D-4wzbA:
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.
4xq2 CALE6

(Micromonospora
echinospora) 		PF01053
(Cys_Met_Meta_PP) 		4 VAL A 255
ARG A 259
VAL A 262
GLY A 278
 None
 0.97A 5x80C-4xq2A:
undetectable
5x80D-4xq2A:
undetectable		 5x80C-4xq2A:
17.75
5x80D-4xq2A:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a2g CARBOXYLIC ESTER
HYDROLASE

(Hungatella
hathewayi) 		PF00135
(COesterase) 		4 ARG A 380
VAL A 387
VAL A 228
GLY A 318
 None
 0.82A 5x80C-5a2gA:
undetectable
5x80D-5a2gA:
undetectable		 5x80C-5a2gA:
15.82
5x80D-5a2gA:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fnu KELCH-LIKE
ECH-ASSOCIATED
PROTEIN 1

(Mus musculus) 		PF01344
(Kelch_1) 		4 VAL A 428
VAL A 377
GLY A 419
TYR A 426
 None
 0.88A 5x80C-5fnuA:
undetectable
5x80D-5fnuA:
undetectable		 5x80C-5fnuA:
19.61
5x80D-5fnuA:
19.61
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.
5gtx BUCKWHEAT
GLUTAREDOXIN

(Polygonaceae) 		PF00462
(Glutaredoxin) 		4 VAL A  33
PRO A  84
GLY A  95
TYR A  41
 None
 1.02A 5x80C-5gtxA:
undetectable
5x80D-5gtxA:
undetectable		 5x80C-5gtxA:
23.84
5x80D-5gtxA:
23.84
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.
5gvh ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[FMN]

(Thermotoga
maritima) 		PF03060
(NMO) 		4 VAL A 118
VAL A 128
PRO A 101
GLY A  99
 None
 0.81A 5x80C-5gvhA:
undetectable
5x80D-5gvhA:
undetectable		 5x80C-5gvhA:
20.77
5x80D-5gvhA:
20.77
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.
5h7j ELONGATION FACTOR 2

(Pyrococcus
horikoshii) 		no annotation 4 VAL A 393
PRO A 628
GLY A 699
TYR A 629
 None
 0.90A 5x80C-5h7jA:
undetectable
5x80D-5h7jA:
undetectable		 5x80C-5h7jA:
21.37
5x80D-5h7jA:
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 ARG A1198
VAL A1082
PRO A1121
GLY A1188
 None
 0.98A 5x80C-5i8iA:
undetectable
5x80D-5i8iA:
2.1		 5x80C-5i8iA:
7.09
5x80D-5i8iA:
7.09
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.
5k8o 5-NITROANTHRANILIC
ACID AMINOHYDROLASE

(Bradyrhizobium
sp.) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 ARG A 301
VAL A 270
PRO A 304
GLY A 208
TYR A 337
 None
 1.40A 5x80C-5k8oA:
undetectable
5x80D-5k8oA:
1.1		 5x80C-5k8oA:
18.63
5x80D-5k8oA:
18.63
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.
5l3z POLYKETIDE
KETOREDUCTASE SIMC7

(Streptomyces
antibioticus) 		PF13460
(NAD_binding_10) 		4 ARG A 215
PRO A 156
GLY A 157
TYR A 155
 None
 0.92A 5x80C-5l3zA:
undetectable
5x80D-5l3zA:
undetectable		 5x80C-5l3zA:
26.71
5x80D-5l3zA:
26.71
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.
5lae PEROXISOMAL
N(1)-ACETYL-SPERMINE
/SPERMIDINE
OXIDASE,PEROXISOMAL
N(1)-ACETYL-SPERMINE
/SPERMIDINE OXIDASE

(Mus musculus) 		PF01593
(Amino_oxidase) 		4 VAL A 433
VAL A 147
GLY A 202
TYR A 204
 None
 0.89A 5x80C-5laeA:
undetectable
5x80D-5laeA:
undetectable		 5x80C-5laeA:
16.19
5x80D-5laeA:
16.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m11 IMMUNOREACTIVE 84KD
ANTIGEN PG93

(Porphyromonas
gingivalis) 		no annotation 5 VAL A 774
VAL A 694
PRO A 696
GLY A 706
TYR A 703
 None
 1.45A 5x80C-5m11A:
undetectable
5x80D-5m11A:
undetectable		 5x80C-5m11A:
11.81
5x80D-5m11A:
11.81
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.
5mjv CAPSID SUBUNIT VP3

(Parechovirus A) 		no annotation 4 ARG B 200
ARG B 120
VAL B 129
GLY B 204
 None
 0.85A 5x80C-5mjvB:
undetectable
5x80D-5mjvB:
undetectable		 5x80C-5mjvB:
20.50
5x80D-5mjvB:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mlc 50S RIBOSOMAL
PROTEIN L3,
CHLOROPLASTIC

(Spinacia
oleracea) 		PF00297
(Ribosomal_L3) 		4 VAL E 139
VAL E 162
GLY E 120
TYR E 141
 None
 0.96A 5x80C-5mlcE:
undetectable
5x80D-5mlcE:
undetectable		 5x80C-5mlcE:
18.89
5x80D-5mlcE:
18.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nkp KELCH-LIKE PROTEIN 3

(Homo sapiens) 		PF01344
(Kelch_1) 		4 VAL A 446
VAL A 399
GLY A 437
TYR A 444
 None
 0.88A 5x80C-5nkpA:
undetectable
5x80D-5nkpA:
undetectable		 5x80C-5nkpA:
19.73
5x80D-5nkpA:
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.
5oms CYTOCHROME P450

(Amycolatopsis
sp. ATCC 39116) 		no annotation 4 VAL A 141
VAL A 365
PRO A 250
GLY A 251
 None
None
HEM  A 501 (-3.7A)
None
 0.75A 5x80C-5omsA:
undetectable
5x80D-5omsA:
undetectable		 5x80C-5omsA:
19.38
5x80D-5omsA:
19.38
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.
5tf0 GLYCOSYL HYDROLASE
FAMILY 3 N-TERMINAL
DOMAIN PROTEIN

(Bacteroides
intestinalis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 VAL A 397
VAL A 694
GLY A 651
TYR A 652
 None
 1.00A 5x80C-5tf0A:
undetectable
5x80D-5tf0A:
undetectable		 5x80C-5tf0A:
15.48
5x80D-5tf0A:
15.48
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.
5w3f TUBULIN ALPHA-1
CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		4 VAL A 376
VAL A 372
PRO A 361
GLY A 322
 None
 0.99A 5x80C-5w3fA:
undetectable
5x80D-5w3fA:
undetectable		 5x80C-5w3fA:
17.31
5x80D-5w3fA:
17.31
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.
5wrl AP-2 COMPLEX SUBUNIT
MU

(Rattus
norvegicus) 		no annotation 4 VAL A 177
VAL A 196
PRO A 396
GLY A 398
 None
 1.00A 5x80C-5wrlA:
undetectable
5x80D-5wrlA:
undetectable		 5x80C-5wrlA:
19.02
5x80D-5wrlA:
19.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wug BETA-GLUCOSIDASE

(Paenibacillus
barengoltzii) 		no annotation 4 VAL A  49
VAL A 347
GLY A 303
TYR A 304
 None
 0.96A 5x80C-5wugA:
undetectable
5x80D-5wugA:
undetectable		 5x80C-5wugA:
30.62
5x80D-5wugA:
30.62
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.
5x6x MRNA CAPPING ENZYME
P5

(Rice dwarf
virus) 		no annotation 4 ARG C 648
VAL C 652
GLY C 670
TYR C 645
 None
None
None
EDO  C 901 (-4.8A)
 0.96A 5x80C-5x6xC:
undetectable
5x80D-5x6xC:
undetectable		 5x80C-5x6xC:
20.26
5x80D-5x6xC:
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.
5yz0 SERINE/THREONINE-PRO
TEIN KINASE ATR

(Homo sapiens) 		no annotation 4 ARG A2148
VAL A2156
GLY A2098
TYR A2097
 None
 0.68A 5x80C-5yz0A:
undetectable
5x80D-5yz0A:
undetectable		 5x80C-5yz0A:
20.00
5x80D-5yz0A:
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.
6f8z ALPHA-1,2-MANNOSIDAS
E, PUTATIVE

(Bacteroides
thetaiotaomicron) 		no annotation 4 ARG A 121
VAL A  27
GLY A 123
TYR A 124
 None
 1.00A 5x80C-6f8zA:
undetectable
5x80D-6f8zA:
undetectable		 5x80C-6f8zA:
21.58
5x80D-6f8zA:
21.58
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.
6fmq -

(-) 		no annotation 4 VAL A 428
VAL A 377
GLY A 419
TYR A 426
 None
 0.89A 5x80C-6fmqA:
undetectable
5x80D-6fmqA:
undetectable		 5x80C-6fmqA:
undetectable
5x80D-6fmqA:
undetectable