SIMILAR PATTERNS OF AMINO ACIDS FOR 1DF7_A_MTXA501

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.
1cid T CELL SURFACE
GLYCOPROTEIN CD4

(Rattus
norvegicus) 		PF05790
(C2-set)
PF09191
(CD4-extracel) 		5 GLN A 135
LEU A 133
VAL A 151
LEU A 117
ILE A 175
 None
 0.97A 1df7A-1cidA:
undetectable		 1df7A-1cidA:
20.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cz3 DIHYDROFOLATE
REDUCTASE

(Thermotoga
maritima) 		PF00186
(DHFR_1) 		5 ALA A   8
ASP A  27
LEU A  55
ARG A  58
ILE A 100
 None
 0.47A 1df7A-1cz3A:
17.5		 1df7A-1cz3A:
31.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1dr6 DIHYDROFOLATE
REDUCTASE

(Gallus gallus) 		PF00186
(DHFR_1) 		6 ILE A   7
ALA A   9
PRO A  61
LEU A  67
ARG A  70
TYR A 121
 HBI  A 198 (-4.1A)
HBI  A 198 ( 3.6A)
None
None
None
None
 0.64A 1df7A-1dr6A:
20.8		 1df7A-1dr6A:
31.38
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.
1h65 CHLOROPLAST OUTER
ENVELOPE PROTEIN
OEP34

(Pisum sativum) 		PF04548
(AIG1) 		5 ILE A 158
LEU A  32
VAL A  37
LEU A  40
ILE A 239
 None
 0.99A 1df7A-1h65A:
undetectable		 1df7A-1h65A:
20.15
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.
1i5e URACIL
PHOSPHORIBOSYLTRANSF
ERASE

([Bacillus]
caldolyticus) 		PF14681
(UPRTase) 		5 ILE A  77
LEU A 118
PRO A 119
LEU A 147
ILE A 100
 None
 0.89A 1df7A-1i5eA:
undetectable		 1df7A-1i5eA:
21.70
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.
1juv DIHYDROFOLATE
REDUCTASE

(Escherichia
virus T4) 		PF00186
(DHFR_1) 		5 ASP A  36
LEU A  59
PRO A  60
LEU A  63
ARG A  66
 None
 0.76A 1df7A-1juvA:
16.8		 1df7A-1juvA:
27.78
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.
1juv DIHYDROFOLATE
REDUCTASE

(Escherichia
virus T4) 		PF00186
(DHFR_1) 		5 ASP A  36
LEU A  59
PRO A  60
LEU A  63
ILE A 127
 None
 0.78A 1df7A-1juvA:
16.8		 1df7A-1juvA:
27.78
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.
1or8 PROTEIN ARGININE
N-METHYLTRANSFERASE
1

(Rattus
norvegicus) 		PF13649
(Methyltransf_25) 		5 ILE A 142
ILE A 123
LEU A 133
PRO A 134
VAL A 135
 None
 0.86A 1df7A-1or8A:
undetectable		 1df7A-1or8A:
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.
1pc3 PHOSPHATE-BINDING
PROTEIN 1

(Mycobacterium
tuberculosis) 		PF12849
(PBP_like_2) 		5 ALA A 106
ILE A 258
LEU A 334
PRO A 335
VAL A 338
 None
 0.97A 1df7A-1pc3A:
undetectable		 1df7A-1pc3A:
17.37
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.
1t2k INTERFERON
REGULATORY FACTOR 3

(Homo sapiens) 		PF00605
(IRF) 		5 ALA A  93
LEU A  16
VAL A  13
LEU A  12
ILE A  36
 None
 0.95A 1df7A-1t2kA:
undetectable		 1df7A-1t2kA:
22.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1u70 DIHYDROFOLATE
REDUCTASE

(Mus musculus) 		PF00186
(DHFR_1) 		6 ILE A   7
ALA A   9
PRO A  61
LEU A  67
ARG A  70
TYR A 121
 MTX  A 187 (-3.8A)
NDP  A 188 (-3.6A)
MTX  A 187 (-4.8A)
MTX  A 187 ( 4.5A)
MTX  A 187 (-3.1A)
None
 0.49A 1df7A-1u70A:
20.6		 1df7A-1u70A:
32.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1u71 DIHYDROFOLATE
REDUCTASE

(Homo sapiens) 		PF00186
(DHFR_1) 		6 ILE A   7
ALA A   9
PRO A  61
LEU A  67
ARG A  70
TYR A 121
 MXA  A 187 (-4.5A)
MXA  A 187 (-3.6A)
MXA  A 187 (-4.4A)
None
None
None
 0.46A 1df7A-1u71A:
21.1		 1df7A-1u71A:
31.58
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.
1upf URACIL
PHOSPHORIBOSYLTRANSF
ERASE

(Toxoplasma
gondii) 		no annotation 5 ILE D  29
ALA D 197
ILE D 229
GLN D 200
ILE D  25
 None
None
URF  D 999 (-4.0A)
None
None
 0.99A 1df7A-1upfD:
undetectable		 1df7A-1upfD:
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.
1usy ATP
PHOSPHORIBOSYLTRANSF
ERASE REGULATORY
SUBUNIT

(Thermotoga
maritima) 		PF13393
(tRNA-synt_His) 		5 ILE C 154
LEU C 197
PRO C 198
VAL C 201
ILE C 179
 None
 0.99A 1df7A-1usyC:
undetectable		 1df7A-1usyC:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y7n AMYLOID BETA A4
PRECURSOR
PROTEIN-BINDING
FAMILY A MEMBER 1

(Homo sapiens) 		PF00595
(PDZ) 		5 ILE A  56
ALA A  65
GLN A  61
LEU A  75
ILE A  55
 None
 0.92A 1df7A-1y7nA:
undetectable		 1df7A-1y7nA:
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.
1yq2 BETA-GALACTOSIDASE

(Arthrobacter
sp. C2-2) 		PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		6 ILE A1020
ALA A 742
LEU A 877
PRO A 878
VAL A 881
LEU A 935
 None
 1.40A 1df7A-1yq2A:
undetectable		 1df7A-1yq2A:
11.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1zdr DIHYDROFOLATE
REDUCTASE

(Geobacillus
stearothermophilus) 		PF00186
(DHFR_1) 		6 ILE A   5
ALA A   7
ASP A  27
LEU A  54
ARG A  57
ILE A  96
 None
None
None
SO4  A3486 (-4.2A)
SO4  A3484 (-3.3A)
None
 0.39A 1df7A-1zdrA:
22.6		 1df7A-1zdrA:
34.73
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.
1zrm L-2-HALOACID
DEHALOGENASE

(Pseudomonas sp.
YL) 		PF13419
(HAD_2) 		6 ILE A 125
LEU A 104
PRO A 101
VAL A 100
LEU A  15
ILE A 116
 None
 1.39A 1df7A-1zrmA:
2.9		 1df7A-1zrmA:
23.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2blb DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Plasmodium
vivax) 		PF00186
(DHFR_1) 		8 ILE A  13
ALA A  15
ASP A  53
PRO A 122
LEU A 128
ARG A 131
ILE A 173
TYR A 179
 CP7  A1240 (-4.1A)
CP7  A1240 (-3.7A)
CP7  A1240 (-3.1A)
None
MES  A1241 (-4.5A)
MES  A1241 (-2.7A)
CP7  A1240 ( 3.8A)
None
 0.69A 1df7A-2blbA:
19.6		 1df7A-2blbA:
24.28
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.
2ft3 BIGLYCAN

(Bos taurus) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		6 ILE A 135
ILE A  93
LEU A 121
PRO A 122
LEU A 128
ILE A 117
 None
 1.42A 1df7A-2ft3A:
undetectable		 1df7A-2ft3A:
19.67
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.
2gop TRILOBED PROTEASE

(Pyrococcus
furiosus) 		PF07676
(PD40) 		5 ILE A 297
LEU A 279
VAL A 265
LEU A 258
ILE A 294
 None
 0.99A 1df7A-2gopA:
undetectable		 1df7A-2gopA:
16.43
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.
2h2q BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Trypanosoma
cruzi) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		7 ALA A  28
ILE A  41
ASP A  48
LEU A  91
ARG A  94
ILE A 154
TYR A 160
 NAP  A 523 (-3.7A)
NAP  A 523 (-4.4A)
None
None
None
None
None
 0.42A 1df7A-2h2qA:
20.0		 1df7A-2h2qA:
19.85
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.
2h2q BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Trypanosoma
cruzi) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		7 ILE A  41
ASP A  48
PRO A  85
LEU A  91
ARG A  94
ILE A 154
TYR A 160
 NAP  A 523 (-4.4A)
None
None
None
None
None
None
 0.69A 1df7A-2h2qA:
20.0		 1df7A-2h2qA:
19.85
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.
2ihm DNA POLYMERASE MU

(Mus musculus) 		PF10391
(DNA_pol_lambd_f)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		5 ILE A 335
LEU A 394
VAL A 360
LEU A 354
ILE A 302
 None
 0.96A 1df7A-2ihmA:
undetectable		 1df7A-2ihmA:
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.
2oip CHAIN A, CRYSTAL
STRUCTURE OF DHFR

(Cryptosporidium
hominis) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		5 ALA A  11
ASP A  32
LEU A  67
ARG A  70
TYR A 119
 MTX  A 605 ( 3.6A)
MTX  A 605 ( 3.0A)
MTX  A 605 ( 4.4A)
MTX  A 605 ( 3.1A)
None
 0.47A 1df7A-2oipA:
21.3		 1df7A-2oipA:
17.45
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.
2vd9 ALANINE RACEMASE

(Bacillus
anthracis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 ILE A  36
ALA A  56
ILE A  19
LEU A 246
ILE A  26
 None
None
None
MLY  A 245 ( 4.1A)
MLY  A  27 ( 3.7A)
 0.89A 1df7A-2vd9A:
undetectable		 1df7A-2vd9A:
17.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w3w DIHYDROFOLATE
REDUCTASE

(Mycobacterium
avium) 		PF00186
(DHFR_1) 		10 ALA A  11
ILE A  24
ASP A  31
LEU A  54
PRO A  55
VAL A  58
LEU A  61
ARG A  64
ILE A 102
TYR A 108
 VG9  A1168 ( 3.8A)
NDP  A1169 ( 4.4A)
VG9  A1168 (-3.0A)
None
VG9  A1168 ( 4.6A)
None
VG9  A1168 ( 4.4A)
VG9  A1168 ( 3.7A)
VG9  A1168 ( 4.2A)
None
 0.53A 1df7A-2w3wA:
28.8		 1df7A-2w3wA:
68.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w9s DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003

(Staphylococcus
aureus) 		PF00186
(DHFR_1) 		6 ILE A   5
ALA A   7
ASP A  27
LEU A  54
ARG A  57
TYR A  98
 TOP  A1160 (-4.2A)
TOP  A1160 ( 3.6A)
TOP  A1160 (-2.8A)
None
None
None
 0.43A 1df7A-2w9sA:
23.6		 1df7A-2w9sA:
32.93
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.
2xci 3-DEOXY-D-MANNO-2-OC
TULOSONIC ACID
TRANSFERASE

(Aquifex
aeolicus) 		PF04413
(Glycos_transf_N) 		5 ILE A 183
LEU A 319
VAL A 316
LEU A 315
ILE A 261
 None
 0.90A 1df7A-2xciA:
undetectable		 1df7A-2xciA:
17.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zpb NITRILE HYDRATASE
SUBUNIT ALPHA

(Rhodococcus
erythropolis) 		PF02979
(NHase_alpha) 		5 ILE A  94
ALA A  80
VAL A 190
LEU A 195
ILE A 119
 None
 0.95A 1df7A-2zpbA:
undetectable		 1df7A-2zpbA:
20.75
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.
3boe CADMIUM-SPECIFIC
CARBONIC ANHYDRASE

(Conticribra
weissflogii) 		no annotation 5 ILE A 242
GLN A 228
LEU A 411
PRO A 408
ILE A 429
 None
 0.97A 1df7A-3boeA:
undetectable		 1df7A-3boeA:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d0q PROTEIN CALG3

(Micromonospora
echinospora) 		PF06722
(DUF1205) 		6 ILE A 227
LEU A 259
PRO A 260
VAL A 263
LEU A 246
ILE A 253
 None
 1.39A 1df7A-3d0qA:
undetectable		 1df7A-3d0qA:
18.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dfr DIHYDROFOLATE
REDUCTASE

(Lactobacillus
casei) 		PF00186
(DHFR_1) 		5 ALA A   6
ASP A  26
PRO A  50
LEU A  54
ARG A  57
 MTX  A 164 (-3.8A)
MTX  A 164 ( 2.9A)
MTX  A 164 ( 4.6A)
MTX  A 164 ( 4.4A)
MTX  A 164 ( 2.9A)
 0.67A 1df7A-3dfrA:
22.5		 1df7A-3dfrA:
34.88
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.
3dg8 BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Plasmodium
falciparum) 		PF00186
(DHFR_1) 		7 ILE A  14
ALA A  16
ASP A  54
PRO A 113
LEU A 119
ARG A 122
TYR A 170
 RJ6  A 609 (-4.5A)
RJ6  A 609 (-3.7A)
RJ6  A 609 (-3.0A)
None
RJ6  A 609 (-4.4A)
None
NDP  A 610 ( 4.9A)
 0.54A 1df7A-3dg8A:
19.7		 1df7A-3dg8A:
22.02
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.
3eya PYRUVATE
DEHYDROGENASE
[CYTOCHROME]

(Escherichia
coli) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		6 ILE A 455
ALA A 411
ASP A 379
LEU A 362
PRO A 359
VAL A 527
 None
 1.19A 1df7A-3eyaA:
undetectable		 1df7A-3eyaA:
14.41
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.
3fcp L-ALA-D/L-GLU
EPIMERASE, A
MUCONATE LACTONIZING
ENZYME

(Klebsiella
pneumoniae) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A  37
ILE A 109
VAL A 125
LEU A 358
ILE A  49
 None
 0.94A 1df7A-3fcpA:
undetectable		 1df7A-3fcpA:
17.87
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.
3gr8 NADPH DEHYDROGENASE

(Geobacillus
kaustophilus) 		PF00724
(Oxidored_FMN) 		5 ALA A 235
ILE A 216
ARG A 205
ILE A 201
TYR A 194
 None
 0.97A 1df7A-3gr8A:
undetectable		 1df7A-3gr8A:
20.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3i8a DIHYDROFOLATE
REDUCTASE

(Staphylococcus
aureus) 		PF00186
(DHFR_1) 		5 ALA X   7
ASP X  27
LEU X  54
ARG X  57
TYR X  98
 N22  X 219 ( 3.6A)
N22  X 219 (-2.8A)
None
None
None
 0.51A 1df7A-3i8aX:
23.3		 1df7A-3i8aX:
31.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ia4 DIHYDROFOLATE
REDUCTASE

(Moritella
profunda) 		PF00186
(DHFR_1) 		6 ILE A   6
ALA A   8
LEU A  55
ARG A  58
ILE A  96
TYR A 102
 MTX  A 164 (-4.0A)
MTX  A 164 ( 3.7A)
MTX  A 164 ( 4.4A)
MTX  A 164 (-2.9A)
MTX  A 164 ( 4.2A)
None
 0.31A 1df7A-3ia4A:
23.9		 1df7A-3ia4A:
36.53
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.
3ilw DNA GYRASE SUBUNIT A

(Mycobacterium
tuberculosis) 		PF00521
(DNA_topoisoIV) 		5 ILE A 302
LEU A 274
PRO A 275
VAL A 278
ILE A 314
 None
 0.79A 1df7A-3ilwA:
undetectable		 1df7A-3ilwA:
17.23
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.
3ilw DNA GYRASE SUBUNIT A

(Mycobacterium
tuberculosis) 		PF00521
(DNA_topoisoIV) 		5 ILE A 316
LEU A 274
PRO A 275
VAL A 278
ILE A 314
 None
 1.00A 1df7A-3ilwA:
undetectable		 1df7A-3ilwA:
17.23
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.
3k2b GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
A, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 ILE A 144
ALA A 134
LEU A  25
PRO A  24
ILE A 117
 None
 1.00A 1df7A-3k2bA:
undetectable		 1df7A-3k2bA:
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.
3ka7 OXIDOREDUCTASE

(Methanosarcina
mazei) 		PF01593
(Amino_oxidase) 		5 ILE A 199
LEU A  57
PRO A  58
LEU A  65
ILE A 198
 None
None
FAD  A 500 (-4.1A)
None
None
 0.86A 1df7A-3ka7A:
undetectable		 1df7A-3ka7A:
17.77
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.
3kjr DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE

(Babesia bovis) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		6 ALA A  16
ILE A  29
ASP A  37
LEU A  80
ARG A  83
TYR A 129
 NAP  A 512 (-3.7A)
NAP  A 512 (-4.5A)
None
None
None
None
 0.44A 1df7A-3kjrA:
20.3		 1df7A-3kjrA:
15.40
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.
3l8a PUTATIVE
AMINOTRANSFERASE,
PROBABLE
BETA-CYSTATHIONASE

(Streptococcus
mutans) 		PF00155
(Aminotran_1_2) 		5 ILE A 382
LEU A 365
VAL A 323
LEU A 325
ILE A 381
 None
 0.99A 1df7A-3l8aA:
undetectable		 1df7A-3l8aA:
17.10
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.
3lnl UPF0135 PROTEIN
SA1388

(Staphylococcus
aureus) 		PF01784
(NIF3) 		5 ILE A 267
ASP A 365
VAL A 112
LEU A 116
ILE A 328
 None
 0.93A 1df7A-3lnlA:
undetectable		 1df7A-3lnlA:
15.85
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.
3lun ULILYSIN

(Methanosarcina
acetivorans) 		PF05572
(Peptidase_M43) 		5 ILE A  64
LEU A 313
VAL A 309
LEU A 234
ILE A  67
 None
 0.88A 1df7A-3lunA:
undetectable		 1df7A-3lunA:
19.85
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.
3nda SERPIN-2

(Ixodes ricinus) 		PF00079
(Serpin) 		5 ALA A 300
ILE A 295
LEU A 166
VAL A 165
ILE A 305
 None
 0.97A 1df7A-3ndaA:
undetectable		 1df7A-3ndaA:
17.40
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.
3ppo GLYCINE
BETAINE/CARNITINE/CH
OLINE-BINDING
PROTEIN

(Bacillus
subtilis) 		PF04069
(OpuAC) 		6 ALA A  48
PRO A 248
VAL A 251
LEU A 258
ILE A 262
TYR A 131
 None
 1.43A 1df7A-3ppoA:
undetectable		 1df7A-3ppoA:
19.05
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.
3qll CITRATE LYASE

(Yersinia pestis) 		PF03328
(HpcH_HpaI) 		5 ILE A  81
ALA A  79
LEU A  97
LEU A 111
ILE A  84
 None
 0.76A 1df7A-3qllA:
undetectable		 1df7A-3qllA:
19.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3rg9 BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Trypanosoma
brucei) 		PF00186
(DHFR_1) 		9 ALA A  34
ILE A  47
ASP A  54
LEU A  90
PRO A  91
LEU A  97
ARG A 100
ILE A 160
TYR A 166
 WRA  A 602 (-3.9A)
WRA  A 602 ( 4.5A)
WRA  A 602 (-2.9A)
WRA  A 602 (-4.8A)
WRA  A 602 (-4.3A)
None
None
WRA  A 602 ( 3.9A)
None
 0.51A 1df7A-3rg9A:
19.6		 1df7A-3rg9A:
32.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rj9 ALCOHOL
DEHYDROGENASE

(Scaptodrosophila
lebanonensis) 		PF00106
(adh_short) 		5 ILE A 132
ILE A 179
LEU A  25
LEU A   3
ILE A  87
 None
 0.99A 1df7A-3rj9A:
undetectable		 1df7A-3rj9A:
19.25
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.
3tc2 KUNITZ-TYPE
PROTEINASE INHIBITOR
P1H5

(Solanum
tuberosum) 		PF00197
(Kunitz_legume) 		5 ILE A  25
LEU A 171
VAL A 162
LEU A 179
ILE A  24
 None
 0.97A 1df7A-3tc2A:
undetectable		 1df7A-3tc2A:
19.19
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.
3th6 TRIOSEPHOSPHATE
ISOMERASE

(Rhipicephalus
microplus) 		PF00121
(TIM) 		5 ILE A 127
ILE A 113
VAL A 200
LEU A 192
ILE A 147
 None
 0.96A 1df7A-3th6A:
undetectable		 1df7A-3th6A:
20.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tq9 DIHYDROFOLATE
REDUCTASE

(Coxiella
burnetii) 		PF00186
(DHFR_1) 		6 ILE A   6
ALA A   8
ASP A  28
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 0.25A 1df7A-3tq9A:
23.1		 1df7A-3tq9A:
36.41
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.
3um6 BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Plasmodium
falciparum) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		7 ILE A  14
ASP A  54
PRO A 113
LEU A 119
ARG A 122
ILE A 164
TYR A 170
 1CY  A 609 (-4.3A)
1CY  A 609 (-2.9A)
None
None
None
1CY  A 609 ( 4.0A)
None
 0.60A 1df7A-3um6A:
19.7		 1df7A-3um6A:
15.66
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.
3um9 HALOACID
DEHALOGENASE, TYPE
II

(Polaromonas sp.
JS666) 		PF13419
(HAD_2) 		6 ILE A 125
LEU A 104
PRO A 101
VAL A 100
LEU A  15
ILE A 116
 None
 1.46A 1df7A-3um9A:
undetectable		 1df7A-3um9A:
19.48
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.
3vco DIHYDROFOLATE
REDUCTASE

(Schistosoma
mansoni) 		PF00186
(DHFR_1) 		7 ALA A   8
ASP A  28
PRO A  58
LEU A  64
ARG A  67
ILE A 111
TYR A 117
 None
 0.73A 1df7A-3vcoA:
17.5		 1df7A-3vcoA:
28.78
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.
3wt0 CELL DIVISION
PROTEIN FTSA

(Staphylococcus
aureus) 		PF02491
(SHS2_FTSA)
PF14450
(FtsA) 		5 ILE A  46
ILE A  81
VAL A 182
LEU A  76
ILE A  11
 None
 1.00A 1df7A-3wt0A:
undetectable		 1df7A-3wt0A:
17.88
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.
4czb NA(+)/H(+)
ANTIPORTER 1

(Methanocaldococcus
jannaschii) 		PF00999
(Na_H_Exchanger) 		6 ILE A  32
ALA A 134
ILE A  69
ASP A 132
VAL A 356
LEU A 292
 None
 1.45A 1df7A-4czbA:
undetectable		 1df7A-4czbA:
15.35
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.
4ddq DNA GYRASE SUBUNIT A

(Bacillus
subtilis) 		PF00521
(DNA_topoisoIV) 		6 ILE A 305
LEU A 264
PRO A 265
VAL A 268
LEU A 273
ILE A 303
 None
 1.34A 1df7A-4ddqA:
undetectable		 1df7A-4ddqA:
16.70
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.
4e4r PHOSPHATE
ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF01515
(PTA_PTB) 		5 ILE A 163
LEU A   4
VAL A   7
LEU A   8
ILE A 321
 None
 0.92A 1df7A-4e4rA:
undetectable		 1df7A-4e4rA:
19.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g8z DIHYDROFOLATE
REDUCTASE

(Pneumocystis
jirovecii) 		PF00186
(DHFR_1) 		7 ILE X  10
ALA X  12
PRO X  66
LEU X  72
ARG X  75
ILE X 123
TYR X 129
 TOP  X 301 (-4.2A)
NDP  X 302 ( 3.8A)
TOP  X 301 (-4.8A)
None
None
TOP  X 301 ( 4.0A)
None
 0.57A 1df7A-4g8zX:
20.1		 1df7A-4g8zX:
30.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gvf BETA-HEXOSAMINIDASE

(Salmonella
enterica) 		PF00933
(Glyco_hydro_3) 		5 ALA A  97
LEU A 121
VAL A 196
LEU A 200
ILE A 150
 None
 0.95A 1df7A-4gvfA:
undetectable		 1df7A-4gvfA:
20.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4h96 DIHYDROFOLATE
REDUCTASE

(Candida
albicans) 		PF00186
(DHFR_1) 		6 ILE A   9
ALA A  11
LEU A  69
ARG A  72
ILE A 112
TYR A 118
 14Q  A 202 (-4.3A)
14Q  A 202 ( 3.7A)
None
None
14Q  A 202 ( 4.2A)
None
 0.53A 1df7A-4h96A:
17.5		 1df7A-4h96A:
30.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4h96 DIHYDROFOLATE
REDUCTASE

(Candida
albicans) 		PF00186
(DHFR_1) 		6 ILE A   9
PRO A  63
LEU A  69
ARG A  72
ILE A 112
TYR A 118
 14Q  A 202 (-4.3A)
None
None
None
14Q  A 202 ( 4.2A)
None
 0.55A 1df7A-4h96A:
17.5		 1df7A-4h96A:
30.05
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.
4h98 DIHYDROFOLATE
REDUCTASE

([Candida]
glabrata) 		PF00186
(DHFR_1) 		7 ILE A   9
ALA A  11
PRO A  63
LEU A  69
ARG A  72
ILE A 121
TYR A 127
 14Q  A 302 (-4.1A)
14Q  A 302 ( 3.4A)
14Q  A 302 (-4.4A)
None
None
14Q  A 302 ( 4.0A)
None
 0.43A 1df7A-4h98A:
18.6		 1df7A-4h98A:
27.51
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.
4ib2 PUTATIVE LIPOPROTEIN

([Ruminococcus]
gnavus) 		PF03180
(Lipoprotein_9) 		6 ILE A 114
ALA A 111
ILE A 250
LEU A  66
VAL A  68
LEU A  52
 None
 1.30A 1df7A-4ib2A:
undetectable		 1df7A-4ib2A:
18.39
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.
4j3b M1 FAMILY
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 ILE A 804
ALA A 806
LEU A 827
PRO A 828
ILE A 856
 None
 0.98A 1df7A-4j3bA:
undetectable		 1df7A-4j3bA:
11.50
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.
4jc8 HOPS COMPONENT VPS33

(Chaetomium
thermophilum) 		PF00995
(Sec1) 		5 ILE A 234
ILE A 612
LEU A 172
LEU A 176
ILE A 235
 None
 0.96A 1df7A-4jc8A:
undetectable		 1df7A-4jc8A:
12.85
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.
4l15 FIDGETIN-LIKE
PROTEIN 1

(Caenorhabditis
elegans) 		PF00004
(AAA)
PF09336
(Vps4_C) 		6 ILE A 365
ILE A 331
LEU A 587
PRO A 588
LEU A 321
ILE A 480
 None
 1.50A 1df7A-4l15A:
undetectable		 1df7A-4l15A:
17.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4m2x DIHYDROFOLATE
REDUCTASE

(Mycobacterium
tuberculosis) 		PF00186
(DHFR_1) 		12 ILE A   5
ALA A   7
ILE A  20
ASP A  27
GLN A  28
LEU A  50
PRO A  51
VAL A  54
LEU A  57
ARG A  60
ILE A  94
TYR A 100
 TMQ  A 202 (-4.0A)
TMQ  A 202 ( 3.5A)
NDP  A 201 (-4.0A)
TMQ  A 202 ( 2.7A)
TMQ  A 202 ( 3.6A)
None
TMQ  A 202 (-4.2A)
None
None
None
TMQ  A 202 ( 3.8A)
None
 0.58A 1df7A-4m2xA:
30.3		 1df7A-4m2xA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4m7v DIHYDROFOLATE
REDUCTASE

(Enterococcus
faecalis) 		PF00186
(DHFR_1) 		5 ILE A   5
ALA A   7
ASP A  27
LEU A  55
ARG A  58
 RAR  A 200 (-4.0A)
RAR  A 200 ( 3.6A)
RAR  A 200 (-2.6A)
RAR  A 200 (-4.2A)
RAR  A 200 ( 3.2A)
 0.47A 1df7A-4m7vA:
22.2		 1df7A-4m7vA:
35.20
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.
4nv0 7-METHYLGUANOSINE
PHOSPHATE-SPECIFIC
5'-NUCLEOTIDASE

(Drosophila
melanogaster) 		PF05822
(UMPH-1) 		5 ILE A 265
ILE A  60
LEU A 160
LEU A 300
ILE A 241
 None
 0.99A 1df7A-4nv0A:
undetectable		 1df7A-4nv0A:
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.
4o6i NUCLEOPROTEIN

(Lymphocytic
choriomeningitis
mammarenavirus) 		PF17290
(Arena_ncap_C) 		5 ILE A 543
GLN A 397
LEU A 446
PRO A 447
LEU A 452
 None
 0.90A 1df7A-4o6iA:
undetectable		 1df7A-4o6iA:
22.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p68 DIHYDROFOLATE
REDUCTASE

(Escherichia
coli) 		PF00186
(DHFR_1) 		6 ILE A   5
ALA A   7
ASP A  27
ARG A  57
ILE A  94
TYR A 100
 MTX  A 201 (-4.1A)
MTX  A 201 ( 4.0A)
MTX  A 201 (-3.0A)
MTX  A 201 (-3.0A)
MTX  A 201 ( 4.3A)
None
 0.18A 1df7A-4p68A:
23.9		 1df7A-4p68A:
34.52
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.
4px9 ATP-DEPENDENT RNA
HELICASE DDX3X

(Homo sapiens) 		PF00270
(DEAD) 		5 ILE A 214
ILE A 179
VAL A 168
LEU A 403
ILE A 213
 None
 0.94A 1df7A-4px9A:
undetectable		 1df7A-4px9A:
21.92
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.
4qjl PHOSPHOPANTETHEINYL
TRANSFERASE, PPTII

(Mycobacterium
ulcerans) 		PF01648
(ACPS) 		5 ALA A 155
LEU A  11
PRO A  12
VAL A  15
ILE A 113
 None
 0.76A 1df7A-4qjlA:
undetectable		 1df7A-4qjlA:
23.85
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.
4u48 PUTATIVE INNER
MEMBRANE LIPOPROTEIN

(Salmonella
enterica) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
PF11974
(MG1) 		5 ILE A 609
LEU A 696
VAL A 654
LEU A 657
ILE A 642
 None
 1.01A 1df7A-4u48A:
undetectable		 1df7A-4u48A:
8.16
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.
4v2e FIBRONECTIN LEUCINE
RICH TRANSMEMBRANE
PROTEIN 3

(Mus musculus) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		5 ILE A  52
LEU A 102
PRO A 103
VAL A 106
LEU A 109
 None
 0.81A 1df7A-4v2eA:
undetectable		 1df7A-4v2eA:
16.62
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.
4yc6 CYCLIN-DEPENDENT
KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		5 ALA A 281
ILE A 187
LEU A 129
LEU A 144
ILE A 112
 None
 0.94A 1df7A-4yc6A:
undetectable		 1df7A-4yc6A:
22.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yeb FIBRONECTIN LEUCINE
RICH TRANSMEMBRANE
PROTEIN 3

(Mus musculus) 		PF13855
(LRR_8) 		5 ILE B  52
LEU B 102
PRO B 103
VAL B 106
LEU B 109
 None
 0.84A 1df7A-4yebB:
undetectable		 1df7A-4yebB:
16.08
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.
5aov GLYOXYLATE REDUCTASE

(Pyrococcus
furiosus) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 ALA A 240
LEU A 198
VAL A 201
LEU A 202
ILE A 222
 NAP  A1335 (-4.8A)
None
None
None
None
 0.94A 1df7A-5aovA:
undetectable		 1df7A-5aovA:
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.
5cpr HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1

(Homo sapiens) 		PF00856
(SET) 		5 ILE B 212
ALA B 214
ILE B 297
VAL B 282
ILE B 271
 None
 0.98A 1df7A-5cprB:
undetectable		 1df7A-5cprB:
16.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5dxv RETHREADED DHFR

(synthetic
construct) 		PF00186
(DHFR_1) 		6 ILE A   5
ALA A   7
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
None
None
None
None
 0.40A 1df7A-5dxvA:
14.2		 1df7A-5dxvA:
30.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dzu ASPARTIC PROTEASE
INHIBITOR 11

(Solanum
tuberosum) 		PF00197
(Kunitz_legume) 		5 ILE A  25
LEU A 173
VAL A 164
LEU A 181
ILE A  24
 GOL  A 201 ( 4.0A)
None
None
None
None
 1.00A 1df7A-5dzuA:
undetectable		 1df7A-5dzuA:
20.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ecx DEHYDROFOLATE
REDUCTASE TYPE I

(Klebsiella
pneumoniae) 		PF00186
(DHFR_1) 		5 ALA A   7
ILE A  20
GLN A  28
ARG A  56
TYR A 102
 5N1  A 202 ( 3.5A)
NAP  A 201 (-4.1A)
5N1  A 202 (-3.4A)
None
None
 0.91A 1df7A-5ecxA:
21.8		 1df7A-5ecxA:
33.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ecx DEHYDROFOLATE
REDUCTASE TYPE I

(Klebsiella
pneumoniae) 		PF00186
(DHFR_1) 		5 ALA A   7
ILE A  20
GLN A  28
LEU A  53
TYR A 102
 5N1  A 202 ( 3.5A)
NAP  A 201 (-4.1A)
5N1  A 202 (-3.4A)
5N1  A 202 ( 4.7A)
None
 0.99A 1df7A-5ecxA:
21.8		 1df7A-5ecxA:
33.14
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.
5es2 UNCHARACTERIZED
PROTEIN LPG0634

(Legionella
pneumophila) 		PF16848
(SoDot-IcmSS) 		5 ALA A 190
LEU A 366
VAL A 369
LEU A 370
ILE A 337
 None
EDO  A 506 (-4.1A)
None
None
ACT  A 505 ( 4.3A)
 0.99A 1df7A-5es2A:
undetectable		 1df7A-5es2A:
15.14
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.
5gqr LEUCINE-RICH REPEAT
RECEPTOR-LIKE
PROTEIN KINASE TDR

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 ILE B 532
LEU B 572
VAL B 591
LEU B 567
ILE B 528
 None
 0.95A 1df7A-5gqrB:
undetectable		 1df7A-5gqrB:
13.04
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT ALPHA
T-COMPLEX PROTEIN 1
SUBUNIT DELTA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		5 ILE d  48
ILE d  35
LEU a  13
LEU a  15
ILE a 545
 None
 0.91A 1df7A-5gw5d:
undetectable		 1df7A-5gw5d:
13.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kvf ZIKA ENVELOPE DIII

(Zika virus) 		PF02832
(Flavi_glycop_C) 		5 ILE E 396
LEU E 378
PRO E 380
VAL E 326
ILE E 389
 None
 0.92A 1df7A-5kvfE:
undetectable		 1df7A-5kvfE:
23.49
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.
5oe5 ANTHRANILATE--COA
LIGASE

(Pseudomonas
aeruginosa) 		PF00501
(AMP-binding) 		5 ALA A 143
GLN A  42
LEU A 122
VAL A 105
LEU A 103
 None
 0.96A 1df7A-5oe5A:
undetectable		 1df7A-5oe5A:
17.52
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.
5t0l BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Toxoplasma
gondii) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		6 ALA A  10
ASP A  31
PRO A  88
LEU A  94
ARG A  97
TYR A 157
 73X  A 704 (-4.0A)
73X  A 704 (-2.8A)
73X  A 704 (-4.0A)
None
None
None
 0.54A 1df7A-5t0lA:
20.2		 1df7A-5t0lA:
17.56
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.
5ucd NAD(P)-DEPENDENT
BENZALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00171
(Aldedh) 		6 ALA A 251
GLN A 247
LEU A 319
VAL A 292
LEU A 295
ILE A 342
 None
 1.30A 1df7A-5ucdA:
undetectable		 1df7A-5ucdA:
17.51
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.
5zbb -

(-) 		no annotation 5 ILE A  72
ILE A  75
LEU A  12
VAL A  15
LEU A  16
 None
 0.97A 1df7A-5zbbA:
undetectable		 1df7A-5zbbA:
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.
6a8l -

(-) 		no annotation 5 ILE A   8
ILE A 151
LEU A 118
LEU A 114
ILE A   6
 None
 0.95A 1df7A-6a8lA:
undetectable		 1df7A-6a8lA:
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.
6axe MALATE SYNTHASE G

(Mycobacterium
marinum) 		PF01274
(Malate_synthase) 		6 ILE A 243
ALA A 255
LEU A 211
VAL A 180
LEU A 232
ILE A 230
 None
 1.44A 1df7A-6axeA:
undetectable		 1df7A-6axeA:
13.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6cxm DIHYDROFOLATE
REDUCTASE

(Mycolicibacterium
smegmatis) 		no annotation 11 ILE A   6
ALA A   8
ILE A  21
ASP A  28
LEU A  51
PRO A  52
VAL A  55
LEU A  58
ARG A  61
ILE A  92
TYR A  98
 MMV  A 202 (-4.0A)
NAP  A 201 (-3.9A)
NAP  A 201 (-3.8A)
MMV  A 202 (-2.9A)
None
MMV  A 202 ( 4.6A)
MMV  A 202 (-4.8A)
MMV  A 202 (-4.2A)
MMV  A 202 (-2.8A)
MMV  A 202 ( 4.2A)
None
 0.48A 1df7A-6cxmA:
27.2		 1df7A-6cxmA:
46.79
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.
6f2x PROTEIN TYROSINE
KINASE A

(Mycobacterium
tuberculosis) 		no annotation 5 ILE A 282
ALA A 279
PRO A  79
VAL A 176
LEU A 171
 None
 0.92A 1df7A-6f2xA:
3.2		 1df7A-6f2xA:
20.39
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.
1cc1 HYDROGENASE (LARGE
SUBUNIT)

(Desulfomicrobium
baculatum) 		PF00374
(NiFeSe_Hases) 		3 TRP L 386
ARG L 377
THR L 385
 None
 0.90A 1df7A-1cc1L:
undetectable		 1df7A-1cc1L:
15.57
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.
1fep FERRIC ENTEROBACTIN
RECEPTOR

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 TRP A 627
ARG A 682
THR A 626
 None
 0.98A 1df7A-1fepA:
undetectable		 1df7A-1fepA:
13.17
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.
1fiz BETA-ACROSIN HEAVY
CHAIN

(Sus scrofa) 		PF00089
(Trypsin) 		3 TRP A 232
ARG A 201
THR A 231
 None
 1.01A 1df7A-1fizA:
undetectable		 1df7A-1fizA:
22.62
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.
1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II

(Saccharomyces
cerevisiae) 		PF00150
(Cellulase) 		3 TRP A 419
ARG A 391
THR A 340
 None
 1.00A 1df7A-1h4pA:
undetectable		 1df7A-1h4pA:
19.64
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.
1itz TRANSKETOLASE

(Zea mays) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		3 TRP A 293
ARG A 104
THR A 297
 None
 0.93A 1df7A-1itzA:
0.3		 1df7A-1itzA:
13.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1js1 TRANSCARBAMYLASE

(Bacteroides
fragilis) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		3 TRP X 256
ARG X 178
THR X 257
 None
 0.91A 1df7A-1js1X:
0.0		 1df7A-1js1X:
18.43
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.
1m3d TYPE IV COLLAGEN
NONCOLLAGENOUS
DOMAIN- ALPHA2

(Bos taurus) 		PF01413
(C4) 		3 TRP C  81
ARG C  75
THR C  58
 None
 0.97A 1df7A-1m3dC:
undetectable		 1df7A-1m3dC:
21.17
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.
1m41 FMNH2-DEPENDENT
ALKANESULFONATE
MONOOXYGENASE

(Escherichia
coli) 		PF00296
(Bac_luciferase) 		3 TRP A 196
ARG A 314
THR A 195
 None
 0.99A 1df7A-1m41A:
undetectable		 1df7A-1m41A:
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.
1m54 CYSTATHIONINE
BETA-SYNTHASE

(Homo sapiens) 		PF00291
(PALP) 		3 TRP A 390
ARG A 182
THR A 383
 None
 0.85A 1df7A-1m54A:
0.0		 1df7A-1m54A:
19.31
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.
1mu2 HIV-2 RT

(Human
immunodeficiency
virus 2) 		PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb) 		3 TRP B 239
ARG B 193
THR B 237
 None
 1.01A 1df7A-1mu2B:
undetectable		 1df7A-1mu2B:
17.14
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.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN
CARBON MONOXIDE
DEHYDROGENASE SMALL
CHAIN

(Oligotropha
carboxidovorans) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		3 TRP B 742
ARG A 112
THR A 140
 None
None
FES  A4907 ( 4.8A)
 0.94A 1df7A-1n60B:
undetectable		 1df7A-1n60B:
12.07
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.
1qce PROTEIN (GP41)

(Simian
immunodeficiency
virus) 		PF00517
(GP41) 		3 TRP A  58
ARG A  63
THR A  68
 None
 0.98A 1df7A-1qceA:
undetectable		 1df7A-1qceA:
21.08
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.
1quu HUMAN SKELETAL
MUSCLE ALPHA-ACTININ
2

(Homo sapiens) 		PF00435
(Spectrin) 		3 TRP A  29
ARG A  20
THR A  28
 None
 0.87A 1df7A-1quuA:
undetectable		 1df7A-1quuA:
18.92
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.
1r76 PECTATE LYASE

(Niveispirillum
irakense) 		PF09492
(Pec_lyase) 		3 TRP A 376
ARG A 289
THR A 349
 None
 0.97A 1df7A-1r76A:
undetectable		 1df7A-1r76A:
19.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t2f L-LACTATE
DEHYDROGENASE B
CHAIN

(Homo sapiens) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 TRP A 148
ARG A 106
THR A 147
 None
OXQ  A 402 (-4.4A)
None
 0.85A 1df7A-1t2fA:
undetectable		 1df7A-1t2fA:
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.
1t61 TYPE IV COLLAGEN

(Bos taurus) 		PF01413
(C4) 		3 TRP A  82
ARG A  76
THR A  59
 None
 0.95A 1df7A-1t61A:
undetectable		 1df7A-1t61A:
22.50
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.
1u2v ACTIN-RELATED
PROTEIN 3

(Bos taurus) 		PF00022
(Actin) 		3 TRP A 153
ARG A 374
THR A 154
 None
ADP  A1001 (-3.3A)
None
 0.56A 1df7A-1u2vA:
undetectable		 1df7A-1u2vA:
18.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vyx ORF K3

(Human
gammaherpesvirus
8) 		PF12906
(RINGv) 		3 TRP A  41
ARG A  60
THR A  43
 None
 0.96A 1df7A-1vyxA:
undetectable		 1df7A-1vyxA:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x9q 4M5.3
ANTI-FLUORESCEIN
SINGLE CHAIN
ANTIBODY FRAGMENT

(Homo sapiens) 		PF07686
(V-set) 		3 TRP A 115
ARG A  38
THR A 111
 FLU  A1341 (-4.8A)
None
None
 0.99A 1df7A-1x9qA:
undetectable		 1df7A-1x9qA:
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.
1xov PLY PROTEIN

(Listeria virus
PSA) 		PF01520
(Amidase_3) 		3 TRP A 267
ARG A  40
THR A 270
 None
 0.90A 1df7A-1xovA:
undetectable		 1df7A-1xovA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y8a HYPOTHETICAL PROTEIN
AF1437

(Archaeoglobus
fulgidus) 		no annotation 3 TRP A   6
ARG A  74
THR A  13
 None
 1.01A 1df7A-1y8aA:
undetectable		 1df7A-1y8aA:
18.51
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.
2a14 INDOLETHYLAMINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF01234
(NNMT_PNMT_TEMT) 		3 TRP A 107
ARG A 123
THR A 108
 None
 0.93A 1df7A-2a14A:
undetectable		 1df7A-2a14A:
19.85
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.
2cow KINESIN-LIKE PROTEIN
KIF13B

(Homo sapiens) 		PF01302
(CAP_GLY) 		3 TRP A  53
ARG A  25
THR A  52
 None
 1.00A 1df7A-2cowA:
undetectable		 1df7A-2cowA:
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.
2fj0 CARBOXYLIC ESTER
HYDROLASE

(Manduca sexta) 		PF00135
(COesterase) 		3 TRP A  38
ARG A  56
THR A  34
 None
 0.92A 1df7A-2fj0A:
undetectable		 1df7A-2fj0A:
15.34
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.
2ilu ALDEHYDE
DEHYDROGENASE A

(Escherichia
coli) 		PF00171
(Aldedh) 		3 TRP A  60
ARG A 161
THR A 169
 None
 0.95A 1df7A-2iluA:
undetectable		 1df7A-2iluA:
17.12
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.
2j63 AP-ENDONUCLEASE

(Leishmania
major) 		PF03372
(Exo_endo_phos) 		3 TRP A 308
ARG A 299
THR A 307
 None
 0.79A 1df7A-2j63A:
undetectable		 1df7A-2j63A:
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.
2kh2 SCFV

(Mus musculus) 		PF07686
(V-set) 		3 TRP B 234
ARG B 173
THR B 233
 None
 1.01A 1df7A-2kh2B:
undetectable		 1df7A-2kh2B:
20.08
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.
2l6p PHAC1, PHAC2 AND
PHAD GENES

(Pseudomonas
aeruginosa) 		PF06155
(DUF971) 		3 TRP A  85
ARG A  94
THR A  84
 None
 0.87A 1df7A-2l6pA:
undetectable		 1df7A-2l6pA:
27.40
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.
2n9v DERMONECROTIC TOXIN

(Pasteurella
multocida) 		PF11647
(MLD) 		3 TRP A   4
ARG A  71
THR A   5
 None
 0.69A 1df7A-2n9vA:
undetectable		 1df7A-2n9vA:
20.75
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.
2o7p RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD

(Escherichia
coli) 		PF00383
(dCMP_cyt_deam_1)
PF01872
(RibD_C) 		3 TRP A 252
ARG A 237
THR A 269
 None
NAP  A 402 (-4.3A)
None
 0.95A 1df7A-2o7pA:
12.0		 1df7A-2o7pA:
19.21
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.
2ofq TRAO

(IncN plasmid
R46) 		PF03524
(CagX) 		3 TRP A 201
ARG A 265
THR A 207
 None
 0.92A 1df7A-2ofqA:
undetectable		 1df7A-2ofqA:
21.15
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.
2p6p GLYCOSYL TRANSFERASE

(Streptomyces
fradiae) 		PF06722
(DUF1205) 		3 TRP A 136
ARG A 190
THR A 135
 GOL  A1005 ( 3.7A)
None
None
 0.97A 1df7A-2p6pA:
undetectable		 1df7A-2p6pA:
20.05
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.
2q0o PROBABLE
TRANSCRIPTIONAL
ACTIVATOR PROTEIN
TRAR
PROBABLE
TRANSCRIPTIONAL
REPRESSOR TRAM

(Sinorhizobium
fredii) 		PF00196
(GerE)
PF03472
(Autoind_bind)
PF09228
(Prok-TraM) 		3 TRP C  44
ARG A 205
THR A 200
 None
 0.73A 1df7A-2q0oC:
undetectable		 1df7A-2q0oC:
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.
2qki COMPLEMENT C3

(Homo sapiens) 		PF01759
(NTR)
PF07677
(A2M_recep) 		3 TRP C1583
ARG C1560
THR C1604
 None
 0.85A 1df7A-2qkiC:
undetectable		 1df7A-2qkiC:
17.68
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.
2qki COMPLEMENT C3

(Homo sapiens) 		PF01759
(NTR)
PF07677
(A2M_recep) 		3 TRP C1605
ARG C1569
THR C1604
 None
 0.99A 1df7A-2qkiC:
undetectable		 1df7A-2qkiC:
17.68
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.
2rdy BH0842 PROTEIN

(Bacillus
halodurans) 		PF14498
(Glyco_hyd_65N_2) 		3 TRP A 732
ARG A 759
THR A 733
 None
 0.95A 1df7A-2rdyA:
undetectable		 1df7A-2rdyA:
11.08
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.
2v6e PROTELEMORASE

(Klebsiella
phage phiKO2) 		PF16684
(Telomere_res) 		3 TRP A 437
ARG A 396
THR A 436
 None
 0.93A 1df7A-2v6eA:
undetectable		 1df7A-2v6eA:
14.87
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.
2wda PUTATIVE SECRETED
LYASE

(Streptomyces
violaceoruber) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		3 TRP A 599
ARG A  60
THR A 607
 None
 1.01A 1df7A-2wdaA:
undetectable		 1df7A-2wdaA:
12.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wyh ALPHA-MANNOSIDASE

(Streptococcus
pyogenes) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		3 TRP A 114
ARG A 102
THR A  55
 None
GOL  A 904 (-4.1A)
None
 0.95A 1df7A-2wyhA:
undetectable		 1df7A-2wyhA:
10.67
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.
2xwb COMPLEMENT C3B
ALPHA' CHAIN

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		3 TRP B1605
ARG B1569
THR B1604
 None
 0.94A 1df7A-2xwbB:
undetectable		 1df7A-2xwbB:
11.56
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.
2yhg CELLULOSE-BINDING
PROTEIN

(Saccharophagus
degradans) 		PF07632
(DUF1593) 		3 TRP A 872
ARG A 766
THR A 913
 None
CL  A1935 (-4.7A)
None
 1.00A 1df7A-2yhgA:
0.8		 1df7A-2yhgA:
17.55
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.
3aib GLUCOSYLTRANSFERASE-
SI

(Streptococcus
mutans) 		PF02324
(Glyco_hydro_70) 		3 TRP A 299
ARG A 273
THR A 298
 None
 0.95A 1df7A-3aibA:
undetectable		 1df7A-3aibA:
11.02
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.
3bdv UNCHARACTERIZED
PROTEIN DUF1234

(Pectobacterium
atrosepticum) 		PF06821
(Ser_hydrolase) 		3 TRP A  44
ARG A  66
THR A  18
 None
 0.94A 1df7A-3bdvA:
undetectable		 1df7A-3bdvA:
22.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dfr DIHYDROFOLATE
REDUCTASE

(Lactobacillus
casei) 		PF00186
(DHFR_1) 		3 TRP A   5
ARG A  31
THR A 116
 None
None
MTX  A 164 ( 4.3A)
 0.49A 1df7A-3dfrA:
22.5		 1df7A-3dfrA:
34.88
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.
3dou RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J

(Thermoplasma
volcanium) 		PF01728
(FtsJ) 		3 TRP A  52
ARG A  81
THR A  53
 SAM  A   1 (-4.0A)
None
None
 0.84A 1df7A-3douA:
2.3		 1df7A-3douA:
19.70
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.
3h0n UNCHARACTERIZED
PROTEIN DUF1470

(Jannaschia sp.
CCS1) 		PF07336
(ABATE)
PF11706
(zf-CGNR) 		3 TRP A 109
ARG A   8
THR A 108
 None
None
GOL  A 205 ( 4.9A)
 1.01A 1df7A-3h0nA:
undetectable		 1df7A-3h0nA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hzu THIOSULFATE
SULFURTRANSFERASE
SSEA

(Mycobacterium
tuberculosis) 		PF00581
(Rhodanese) 		3 TRP A 255
ARG A 246
THR A 254
 None
 0.82A 1df7A-3hzuA:
undetectable		 1df7A-3hzuA:
22.55
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.
3isa PUTATIVE ENOYL-COA
HYDRATASE/ISOMERASE

(Bordetella
parapertussis) 		PF00378
(ECH_1) 		3 TRP A  19
ARG A 124
THR A  20
 None
 0.92A 1df7A-3isaA:
undetectable		 1df7A-3isaA:
18.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ita D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACC

(Escherichia
coli) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		3 TRP A 254
ARG A 244
THR A 253
 None
AIX  A 500 (-3.0A)
None
 0.95A 1df7A-3itaA:
undetectable		 1df7A-3itaA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k2w BETAINE-ALDEHYDE
DEHYDROGENASE

(Pseudoalteromonas
atlantica) 		PF00171
(Aldedh) 		3 TRP A  64
ARG A 165
THR A 173
 None
 0.97A 1df7A-3k2wA:
undetectable		 1df7A-3k2wA:
15.00
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.
3kpx APOPHOTOPROTEIN
CLYTIN-3

(Clytia gregaria) 		PF13202
(EF-hand_5) 		3 TRP A  21
ARG A 115
THR A 184
 None
 0.84A 1df7A-3kpxA:
undetectable		 1df7A-3kpxA:
19.70
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.
3m1c ENVELOPE
GLYCOPROTEIN H

(Human
alphaherpesvirus
2) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C) 		3 TRP A 244
ARG A 266
THR A 243
 None
 0.99A 1df7A-3m1cA:
undetectable		 1df7A-3m1cA:
11.55
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.
3m3p GLUTAMINE AMIDO
TRANSFERASE

(Methylobacillus
flagellatus) 		PF00117
(GATase) 		3 TRP A 228
ARG A 216
THR A 224
 None
 0.95A 1df7A-3m3pA:
undetectable		 1df7A-3m3pA:
24.30
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.
3ow2 50S RIBOSOMAL
PROTEIN L2P

(Haloarcula
marismortui) 		PF00181
(Ribosomal_L2)
PF03947
(Ribosomal_L2_C) 		3 TRP A 186
ARG A  51
THR A 184
 A  01847 ( 4.1A)
U  01874 ( 4.6A)
U  01879 ( 3.1A)
 0.88A 1df7A-3ow2A:
undetectable		 1df7A-3ow2A:
22.61
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.
3pfq PROTEIN KINASE C
BETA TYPE

(Rattus
norvegicus) 		PF00069
(Pkinase)
PF00130
(C1_1)
PF00168
(C2)
PF00433
(Pkinase_C) 		3 TRP A 223
ARG A 252
THR A 214
 None
 0.85A 1df7A-3pfqA:
undetectable		 1df7A-3pfqA:
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.
3qvf FOMA PROTEIN

(Streptomyces
wedmorensis) 		PF00696
(AA_kinase) 		3 TRP A 251
ARG A  34
THR A 245
 None
 0.93A 1df7A-3qvfA:
1.1		 1df7A-3qvfA:
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.
3zdp NUCLEOCAPSID PROTEIN

(Influenza A
virus) 		PF00506
(Flu_NP) 		3 TRP A 120
ARG A 175
THR A 130
 None
 0.94A 1df7A-3zdpA:
undetectable		 1df7A-3zdpA:
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.
4aov ISOCITRATE
DEHYDROGENASE [NADP]

(Desulfotalea
psychrophila) 		PF00180
(Iso_dh) 		3 TRP A 332
ARG A 396
THR A 333
 None
 0.99A 1df7A-4aovA:
2.4		 1df7A-4aovA:
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.
4auk RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE M

(Escherichia
coli) 		PF01728
(FtsJ) 		3 TRP A 225
ARG A 258
THR A 226
 None
 0.76A 1df7A-4aukA:
1.9		 1df7A-4aukA:
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.
4csd FUCOSE-BINDING
LECTIN PROTEIN

(Ralstonia
solanacearum) 		PF07938
(Fungal_lectin) 		3 TRP A  74
ARG A 108
THR A  71
 None
MFU  A 301 (-3.8A)
None
 0.96A 1df7A-4csdA:
undetectable		 1df7A-4csdA:
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.
4csd FUCOSE-BINDING
LECTIN PROTEIN

(Ralstonia
solanacearum) 		PF07938
(Fungal_lectin) 		3 TRP A 165
ARG A 199
THR A 162
 None
MFU  A 303 (-3.8A)
None
 1.00A 1df7A-4csdA:
undetectable		 1df7A-4csdA:
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.
4csd FUCOSE-BINDING
LECTIN PROTEIN

(Ralstonia
solanacearum) 		PF07938
(Fungal_lectin) 		3 TRP A 256
ARG A  17
THR A 253
 None
MFU  A 305 (-3.8A)
None
 0.99A 1df7A-4csdA:
undetectable		 1df7A-4csdA:
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.
4eog PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF09455
(Cas_DxTHG) 		3 TRP A  10
ARG A 212
THR A  33
 None
 1.00A 1df7A-4eogA:
1.3		 1df7A-4eogA:
16.95
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.
4hpn PUTATIVE
UNCHARACTERIZED
PROTEIN

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 298
ARG A 374
THR A 300
 None
 0.82A 1df7A-4hpnA:
undetectable		 1df7A-4hpnA:
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.
4i6m ACTIN-RELATED
PROTEIN 7

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		3 TRP A 437
ARG A  88
THR A  17
 None
 0.99A 1df7A-4i6mA:
undetectable		 1df7A-4i6mA:
15.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4izx RICIN B-LIKE LECTIN

(Macrolepiota
procera) 		PF14200
(RicinB_lectin_2) 		3 TRP A 128
ARG A  89
THR A 127
 None
BAM  A 202 (-3.9A)
None
 0.99A 1df7A-4izxA:
undetectable		 1df7A-4izxA:
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.
4jxu PUTATIVE
AMINOTRANSFERASE

(Sinorhizobium
meliloti) 		PF01063
(Aminotran_4) 		3 TRP A 103
ARG A  63
THR A 119
 None
 0.99A 1df7A-4jxuA:
undetectable		 1df7A-4jxuA:
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.
4k6m POLYPROTEIN

(Japanese
encephalitis
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		3 TRP A 171
ARG A 160
THR A 168
 None
 0.96A 1df7A-4k6mA:
undetectable		 1df7A-4k6mA:
10.59
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.
4nnb OBCA, OXALATE
BIOSYNTHETIC
COMPONENT A

(Burkholderia
glumae) 		PF05853
(BKACE) 		3 TRP A 494
ARG A 195
THR A 493
 None
 0.96A 1df7A-4nnbA:
undetectable		 1df7A-4nnbA:
15.19
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.
4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE

(Entamoeba
histolytica) 		PF03770
(IPK) 		3 TRP A  58
ARG A  84
THR A  59
 None
 0.96A 1df7A-4o4fA:
undetectable		 1df7A-4o4fA:
18.80
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.
4o5p UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF09994
(DUF2235) 		3 TRP A 367
ARG A 350
THR A 368
 None
 0.98A 1df7A-4o5pA:
undetectable		 1df7A-4o5pA:
10.56
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.
4tx8 PROBABLE CHITINASE A

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		3 TRP A 374
ARG A 388
THR A 373
 FLC  A 505 (-3.0A)
None
None
 0.76A 1df7A-4tx8A:
undetectable		 1df7A-4tx8A:
14.38
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.
4uer EIF3B

(Lachancea
kluyveri) 		PF00318
(Ribosomal_S2) 		3 TRP b 642
ARG b 688
THR b 641
 None
 0.98A 1df7A-4uerb:
undetectable		 1df7A-4uerb:
11.83
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.
4uy6 HISTIDINE-SPECIFIC
METHYLTRANSFERASE
EGTD

(Mycolicibacterium
smegmatis) 		PF10017
(Methyltransf_33) 		3 TRP A 307
ARG A  60
THR A  68
 None
None
TRS  A1801 (-4.0A)
 0.88A 1df7A-4uy6A:
2.0		 1df7A-4uy6A:
21.05
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.
4zel DOPAMINE
BETA-HYDROXYLASE

(Homo sapiens) 		PF01082
(Cu2_monooxygen)
PF03351
(DOMON)
PF03712
(Cu2_monoox_C) 		3 TRP A 104
ARG A  79
THR A 105
 None
 0.89A 1df7A-4zelA:
undetectable		 1df7A-4zelA:
13.98
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.
4zxb INSULIN RECEPTOR

(Homo sapiens) 		PF00041
(fn3)
PF00757
(Furin-like)
PF01030
(Recep_L_domain) 		3 TRP E 489
ARG E 498
THR E 568
 None
 0.83A 1df7A-4zxbE:
undetectable		 1df7A-4zxbE:
11.80
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.
5ch8 MONO- AND
DIACYLGLYCEROL
LIPASE

(Penicillium
cyclopium) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		3 TRP A 116
ARG A 175
THR A 156
 None
 0.97A 1df7A-5ch8A:
undetectable		 1df7A-5ch8A:
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.
5eyb DNA-BINDING PROTEIN
REB1

(Schizosaccharomyces
pombe) 		PF00249
(Myb_DNA-binding) 		3 TRP A 395
ARG A 352
THR A 396
 None
 0.92A 1df7A-5eybA:
undetectable		 1df7A-5eybA:
18.97
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.
5fcl CRISPR-ASSOCIATED
ENDONUCLEASE CAS1

(Pectobacterium
atrosepticum) 		PF01867
(Cas_Cas1) 		3 TRP A 243
ARG A 260
THR A 242
 None
 0.88A 1df7A-5fclA:
undetectable		 1df7A-5fclA:
18.02
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.
5gva WD REPEAT AND
HMG-BOX DNA-BINDING
PROTEIN 1

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		3 TRP A 238
ARG A 287
THR A 237
 None
 1.00A 1df7A-5gvaA:
undetectable		 1df7A-5gvaA:
19.52
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.
5izd D-GLYCERALDEHYDE
DEHYDROGENASE
(NADP(+))

(Thermoplasma
acidophilum) 		PF00171
(Aldedh) 		3 TRP A  56
ARG A 157
THR A 165
 None
 0.88A 1df7A-5izdA:
undetectable		 1df7A-5izdA:
15.81
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.
5j6s ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 2

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		3 TRP A 955
ARG A 674
THR A 951
 None
 0.83A 1df7A-5j6sA:
undetectable		 1df7A-5j6sA:
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.
5jjw SQUAMOUS CELL
CARCINOMA ANTIGEN
RECOGNIZED BY
T-CELLS 3

(Homo sapiens) 		no annotation 3 TRP A 382
ARG A 349
THR A 378
 None
EDO  A 601 (-4.2A)
None
 1.01A 1df7A-5jjwA:
undetectable		 1df7A-5jjwA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kbp GLYCOSYL HYDROLASE,
FAMILY 38

(Enterococcus
faecalis) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		3 TRP A 114
ARG A 102
THR A  55
 None
 0.87A 1df7A-5kbpA:
undetectable		 1df7A-5kbpA:
10.51
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.
5ldd CCZ1

(Chaetomium
thermophilum) 		PF08217
(DUF1712) 		3 TRP B 242
ARG B 233
THR B 241
 None
 0.85A 1df7A-5lddB:
undetectable		 1df7A-5lddB:
21.90
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.
5mms CYSTATHIONINE
BETA-SYNTHASE

(Homo sapiens) 		PF00291
(PALP) 		3 TRP A 390
ARG A 182
THR A 383
 None
 0.86A 1df7A-5mmsA:
2.0		 1df7A-5mmsA:
16.91
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.
5ngy DSR-M GLUCANSUCRASE
INACTIVE MUTANT
E715Q

(Leuconostoc
citreum) 		no annotation 3 TRP A 479
ARG A 453
THR A 478
 None
 0.86A 1df7A-5ngyA:
undetectable		 1df7A-5ngyA:
8.22
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.
5oa3 EUKARYOTIC
TRANSLATION
INITIATION FACTOR 2D

(Homo sapiens) 		no annotation 3 TRP 0  99
ARG 0 164
THR 0  98
 None
 0.96A 1df7A-5oa30:
undetectable		 1df7A-5oa30:
14.55
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.
5ovo ADP-RIBOSYL-(DINITRO
GEN REDUCTASE)
HYDROLASE

(Azospirillum
brasilense) 		no annotation 3 TRP A 149
ARG A 176
THR A 150
 None
 0.99A 1df7A-5ovoA:
undetectable		 1df7A-5ovoA:
19.60
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.
5tf0 GLYCOSYL HYDROLASE
FAMILY 3 N-TERMINAL
DOMAIN PROTEIN

(Bacteroides
intestinalis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 TRP A 566
ARG A 560
THR A 565
 None
 0.95A 1df7A-5tf0A:
1.3		 1df7A-5tf0A:
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.
5ulv MALATE DEHYDROGENASE

(Methylobacterium
extorquens) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 TRP A 202
ARG A 185
THR A 203
 None
 0.99A 1df7A-5ulvA:
undetectable		 1df7A-5ulvA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vsj ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE
1

(Streptomyces
coelicolor) 		PF00128
(Alpha-amylase)
PF11896
(DUF3416) 		3 TRP A 114
ARG A 191
THR A 113
 None
 1.00A 1df7A-5vsjA:
undetectable		 1df7A-5vsjA:
12.79
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 TRP A 564
ARG A 558
THR A 563
 None
 1.00A 1df7A-5xxoA:
1.2		 1df7A-5xxoA:
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		3 TRP C4121
ARG C3965
THR C4120
 None
 0.96A 1df7A-5y3rC:
undetectable		 1df7A-5y3rC:
3.27
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.
5y9h SAFD,PUTATIVE OUTER
MEMBRANE
PROTEIN,PUTATIVE
OUTER MEMBRANE
PROTEIN,PUTATIVE
OUTER MEMBRANE
PROTEIN

(Salmonella
enterica) 		no annotation 3 TRP A 259
ARG A 246
THR A 221
 None
 0.98A 1df7A-5y9hA:
undetectable		 1df7A-5y9hA:
17.58
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.
5ykn PROBABLE
LYSINE-SPECIFIC
DEMETHYLASE JMJ14

(Arabidopsis
thaliana) 		no annotation 3 TRP A 455
ARG A 562
THR A 451
 None
 1.00A 1df7A-5yknA:
undetectable		 1df7A-5yknA:
16.35
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.
5yqq MEMBRANE-ANCHORED
LIPID-BINDING
PROTEIN YSP2

(Saccharomyces
cerevisiae) 		no annotation 3 TRP A1172
ARG A1167
THR A1178
 None
 0.65A 1df7A-5yqqA:
undetectable		 1df7A-5yqqA:
21.62
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.
5yud BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 1E

(Mus musculus) 		no annotation 3 TRP A 207
ARG A 144
THR A 194
 None
 0.82A 1df7A-5yudA:
undetectable		 1df7A-5yudA:
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.
6eoq DIPEPTIDYL PEPTIDASE
9

(Homo sapiens) 		no annotation 3 TRP A 210
ARG A 274
THR A 223
 None
 0.95A 1df7A-6eoqA:
undetectable		 1df7A-6eoqA:
19.11
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.
6fik POLYKETIDE SYNTHASE

(Cercospora
nicotianae) 		no annotation 3 TRP A 852
ARG A 903
THR A 851
 None
 0.87A 1df7A-6fikA:
undetectable		 1df7A-6fikA:
22.15