SIMILAR PATTERNS OF AMINO ACIDS FOR 1SN5_D_T3D602_1

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.
1ch4 MODULE-SUBSTITUTED
CHIMERA HEMOGLOBIN
BETA-ALPHA

(Homo sapiens) 		PF00042
(Globin) 		5 LEU A  68
VAL A 133
LEU A 130
LEU A 111
VAL A  20
 None
 1.14A 1sn5B-1ch4A:
undetectable
1sn5D-1ch4A:
undetectable		 1sn5B-1ch4A:
24.38
1sn5D-1ch4A:
24.38
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.
1cvr GINGIPAIN R

(Porphyromonas
gingivalis) 		PF01364
(Peptidase_C25)
PF03785
(Peptidase_C25_C) 		5 ALA A 358
LEU A 415
ALA A 380
LEU A 382
VAL A 394
 None
 1.06A 1sn5B-1cvrA:
undetectable
1sn5D-1cvrA:
0.0		 1sn5B-1cvrA:
14.67
1sn5D-1cvrA:
14.67
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.
1fno PEPTIDASE T

(Salmonella
enterica) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 LEU A 333
ALA A 336
VAL A 396
LEU A 371
GLU A 202
 None
 1.06A 1sn5B-1fnoA:
0.0
1sn5D-1fnoA:
0.0		 1sn5B-1fnoA:
16.47
1sn5D-1fnoA:
16.47
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.
1fno PEPTIDASE T

(Salmonella
enterica) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 LEU A 371
GLU A 202
LEU A 333
ALA A 336
VAL A 396
 None
 1.09A 1sn5B-1fnoA:
0.0
1sn5D-1fnoA:
0.0		 1sn5B-1fnoA:
16.47
1sn5D-1fnoA:
16.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gke TRANSTHYRETIN

(Rattus
norvegicus) 		PF00576
(Transthyretin) 		6 LYS A  15
LEU A  17
GLU A  54
ALA A 108
LEU A 110
VAL A 121
 None
 0.60A 1sn5B-1gkeA:
20.2
1sn5D-1gkeA:
19.9		 1sn5B-1gkeA:
56.92
1sn5D-1gkeA:
56.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gke TRANSTHYRETIN

(Rattus
norvegicus) 		PF00576
(Transthyretin) 		6 LYS A  15
LEU A  17
GLU A  54
ALA A 108
LEU A 110
VAL A 121
 None
 0.62A 1sn5B-1gkeA:
20.2
1sn5D-1gkeA:
19.9		 1sn5B-1gkeA:
56.92
1sn5D-1gkeA:
56.92
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.
1kbz DTDP-GLUCOSE
OXIDOREDUCTASE

(Salmonella
enterica) 		PF04321
(RmlD_sub_bind) 		5 ALA A  61
VAL A  59
LEU A  16
ALA A 189
VAL A 154
 None
 1.01A 1sn5B-1kbzA:
undetectable
1sn5D-1kbzA:
undetectable		 1sn5B-1kbzA:
19.32
1sn5D-1kbzA:
19.32
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.
1kbz DTDP-GLUCOSE
OXIDOREDUCTASE

(Salmonella
enterica) 		PF04321
(RmlD_sub_bind) 		5 LEU A  16
ALA A 189
VAL A 154
ALA A  61
VAL A  59
 None
 1.01A 1sn5B-1kbzA:
undetectable
1sn5D-1kbzA:
undetectable		 1sn5B-1kbzA:
19.32
1sn5D-1kbzA:
19.32
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.
1l7p PHOSPHOSERINE
PHOSPHATASE

(Methanocaldococcus
jannaschii) 		PF12710
(HAD) 		5 LYS A 177
LEU A 159
ALA A 178
LEU A   9
ALA A 152
 None
 0.99A 1sn5B-1l7pA:
0.0
1sn5D-1l7pA:
0.0		 1sn5B-1l7pA:
17.27
1sn5D-1l7pA:
17.27
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.
1qp8 FORMATE
DEHYDROGENASE

(Pyrobaculum
aerophilum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 LEU A 215
VAL A 255
LEU A 224
LEU A 221
VAL A 192
 None
 1.13A 1sn5B-1qp8A:
0.0
1sn5D-1qp8A:
0.0		 1sn5B-1qp8A:
18.77
1sn5D-1qp8A:
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.
1qp8 FORMATE
DEHYDROGENASE

(Pyrobaculum
aerophilum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 LEU A 224
LEU A 221
VAL A 192
LEU A 215
VAL A 255
 None
 1.13A 1sn5B-1qp8A:
0.0
1sn5D-1qp8A:
0.0		 1sn5B-1qp8A:
18.77
1sn5D-1qp8A:
18.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1sn2 TRANSTHYRETIN

(Sparus aurata) 		PF00576
(Transthyretin) 		6 LYS A  15
LEU A  17
GLU A  54
ALA A 108
LEU A 110
VAL A 121
 None
 0.11A 1sn5B-1sn2A:
23.9
1sn5D-1sn2A:
23.6		 1sn5B-1sn2A:
100.00
1sn5D-1sn2A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1sn2 TRANSTHYRETIN

(Sparus aurata) 		PF00576
(Transthyretin) 		6 LYS A  15
LEU A  17
GLU A  54
ALA A 108
LEU A 110
VAL A 121
 None
 0.15A 1sn5B-1sn2A:
23.9
1sn5D-1sn2A:
23.6		 1sn5B-1sn2A:
100.00
1sn5D-1sn2A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tfp TRANSTHYRETIN

(Gallus gallus) 		PF00576
(Transthyretin) 		6 LYS A  15
LEU A  17
GLU A  54
ALA A 108
LEU A 110
VAL A 121
 None
 0.35A 1sn5B-1tfpA:
18.9
1sn5D-1tfpA:
19.1		 1sn5B-1tfpA:
62.31
1sn5D-1tfpA:
62.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tfp TRANSTHYRETIN

(Gallus gallus) 		PF00576
(Transthyretin) 		6 LYS A  15
LEU A  17
GLU A  54
ALA A 108
LEU A 110
VAL A 121
 None
 0.39A 1sn5B-1tfpA:
18.9
1sn5D-1tfpA:
19.1		 1sn5B-1tfpA:
62.31
1sn5D-1tfpA:
62.31
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.
1vj7 BIFUNCTIONAL
RELA/SPOT

(Streptococcus
dysgalactiae) 		PF04607
(RelA_SpoT)
PF13328
(HD_4) 		5 LEU A  64
ALA A  62
LEU A  66
VAL A  12
ALA A 143
 None
 1.02A 1sn5B-1vj7A:
0.0
1sn5D-1vj7A:
0.0		 1sn5B-1vj7A:
14.69
1sn5D-1vj7A:
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.
1vlm SAM-DEPENDENT
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		5 LEU A 123
LEU A 117
VAL A  59
LEU A  84
GLU A  82
 None
 1.14A 1sn5B-1vlmA:
undetectable
1sn5D-1vlmA:
undetectable		 1sn5B-1vlmA:
21.52
1sn5D-1vlmA:
21.52
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.
1wfy RAP1/RAP2
INTERACTING PROTEIN
REGULATOR OF
G-PROTEIN SIGNALING
14

(Mus musculus) 		PF02196
(RBD) 		5 GLU A  65
LEU A  85
VAL A  78
LEU A  40
LEU A  44
 None
 1.01A 1sn5B-1wfyA:
undetectable
1sn5D-1wfyA:
undetectable		 1sn5B-1wfyA:
19.23
1sn5D-1wfyA:
19.23
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.
1wfy RAP1/RAP2
INTERACTING PROTEIN
REGULATOR OF
G-PROTEIN SIGNALING
14

(Mus musculus) 		PF02196
(RBD) 		5 LEU A  40
LEU A  44
GLU A  65
LEU A  85
VAL A  78
 None
 1.02A 1sn5B-1wfyA:
undetectable
1sn5D-1wfyA:
undetectable		 1sn5B-1wfyA:
19.23
1sn5D-1wfyA:
19.23
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.
1xfc ALANINE RACEMASE

(Mycobacterium
tuberculosis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 LEU A  37
ALA A  57
VAL A  53
LEU A  65
VAL A 227
 None
 0.91A 1sn5B-1xfcA:
undetectable
1sn5D-1xfcA:
undetectable		 1sn5B-1xfcA:
16.62
1sn5D-1xfcA:
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.
1xfc ALANINE RACEMASE

(Mycobacterium
tuberculosis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 LEU A  65
VAL A 227
LEU A  37
ALA A  57
VAL A  53
 None
 0.91A 1sn5B-1xfcA:
undetectable
1sn5D-1xfcA:
undetectable		 1sn5B-1xfcA:
16.62
1sn5D-1xfcA:
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.
2ddz 190AA LONG
HYPOTHETICAL PROTEIN

(Pyrococcus
horikoshii) 		PF04017
(DUF366) 		6 GLU A 166
ALA A 171
LEU A  95
VAL A 173
LEU A  91
VAL A  69
 None
 1.48A 1sn5B-2ddzA:
undetectable
1sn5D-2ddzA:
undetectable		 1sn5B-2ddzA:
17.14
1sn5D-2ddzA:
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.
2fkz BACTERIOFERRITIN

(Azotobacter
vinelandii) 		PF00210
(Ferritin) 		5 GLU A 109
ALA A 104
LEU A 101
VAL A   7
LEU A  11
 None
 1.11A 1sn5B-2fkzA:
undetectable
1sn5D-2fkzA:
undetectable		 1sn5B-2fkzA:
18.87
1sn5D-2fkzA:
18.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fkz BACTERIOFERRITIN

(Azotobacter
vinelandii) 		PF00210
(Ferritin) 		5 LEU A  11
GLU A 109
ALA A 104
LEU A 101
VAL A   7
 None
 1.12A 1sn5B-2fkzA:
undetectable
1sn5D-2fkzA:
undetectable		 1sn5B-2fkzA:
18.87
1sn5D-2fkzA:
18.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hih LIPASE 46 KDA FORM

(Staphylococcus
hyicus) 		no annotation 5 LEU A 132
GLU A  72
LEU A 158
GLU A 144
LEU A 137
 None
ZN  A 601 (-2.0A)
None
None
None
 1.05A 1sn5B-2hihA:
undetectable
1sn5D-2hihA:
undetectable		 1sn5B-2hihA:
16.76
1sn5D-2hihA:
16.76
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.
2hih LIPASE 46 KDA FORM

(Staphylococcus
hyicus) 		no annotation 5 LEU A 158
GLU A 144
LEU A 137
LEU A 132
GLU A  72
 None
None
None
None
ZN  A 601 (-2.0A)
 1.07A 1sn5B-2hihA:
undetectable
1sn5D-2hihA:
undetectable		 1sn5B-2hihA:
16.76
1sn5D-2hihA:
16.76
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.
2iw1 LIPOPOLYSACCHARIDE
CORE BIOSYNTHESIS
PROTEIN RFAG

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF13439
(Glyco_transf_4) 		5 LEU A 275
LEU A 231
LEU A 221
GLU A 329
ALA A 217
 None
 1.12A 1sn5B-2iw1A:
undetectable
1sn5D-2iw1A:
undetectable		 1sn5B-2iw1A:
16.80
1sn5D-2iw1A:
16.80
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.
2j4d CRYPTOCHROME DASH

(Arabidopsis
thaliana) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 LEU A  50
LEU A 102
LEU A  78
GLU A 149
LEU A  74
 None
None
None
MHF  A1499 (-2.8A)
None
 1.08A 1sn5B-2j4dA:
undetectable
1sn5D-2j4dA:
undetectable		 1sn5B-2j4dA:
14.34
1sn5D-2j4dA:
14.34
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.
2j4d CRYPTOCHROME DASH

(Arabidopsis
thaliana) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 LEU A  78
GLU A 149
LEU A  74
LEU A  50
LEU A 102
 None
MHF  A1499 (-2.8A)
None
None
None
 1.10A 1sn5B-2j4dA:
undetectable
1sn5D-2j4dA:
undetectable		 1sn5B-2j4dA:
14.34
1sn5D-2j4dA:
14.34
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.
2kyz HEAVY METAL BINDING
PROTEIN

(Thermotoga
maritima) 		PF00403
(HMA) 		5 GLU A  32
VAL A   7
LEU A  54
LEU A  51
VAL A  28
 None
 1.14A 1sn5B-2kyzA:
undetectable
1sn5D-2kyzA:
undetectable		 1sn5B-2kyzA:
16.15
1sn5D-2kyzA:
16.15
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.
2kyz HEAVY METAL BINDING
PROTEIN

(Thermotoga
maritima) 		PF00403
(HMA) 		5 LEU A  54
LEU A  51
VAL A  28
GLU A  32
VAL A   7
 None
 1.13A 1sn5B-2kyzA:
undetectable
1sn5D-2kyzA:
undetectable		 1sn5B-2kyzA:
16.15
1sn5D-2kyzA:
16.15
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.
2qzq AXIN INTERACTOR,
DORSALIZATION
ASSOCIATED PROTEIN

(Danio rerio) 		PF14186
(Aida_C2) 		5 LEU A  25
LEU A  33
VAL A  58
LEU A  98
LEU A  95
 None
 1.08A 1sn5B-2qzqA:
2.9
1sn5D-2qzqA:
2.7		 1sn5B-2qzqA:
18.18
1sn5D-2qzqA:
18.18
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.
2qzq AXIN INTERACTOR,
DORSALIZATION
ASSOCIATED PROTEIN

(Danio rerio) 		PF14186
(Aida_C2) 		5 LEU A  98
LEU A  95
LEU A  25
LEU A  33
VAL A  58
 None
 1.09A 1sn5B-2qzqA:
2.9
1sn5D-2qzqA:
2.7		 1sn5B-2qzqA:
18.18
1sn5D-2qzqA:
18.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fc8 TRANSTHYRETIN

(Homo sapiens) 		PF00576
(Transthyretin) 		5 LEU A  17
GLU A  54
ALA A 108
LEU A 110
VAL A 121
 IFA  A3000 ( 4.7A)
None
IFA  A3000 (-3.1A)
IFA  A3000 (-4.1A)
None
 0.67A 1sn5B-3fc8A:
20.9
1sn5D-3fc8A:
21.0		 1sn5B-3fc8A:
55.12
1sn5D-3fc8A:
55.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fc8 TRANSTHYRETIN

(Homo sapiens) 		PF00576
(Transthyretin) 		5 LYS A  15
LEU A  17
GLU A  54
ALA A 108
LEU A 110
 IFA  A3000 (-3.0A)
IFA  A3000 ( 4.7A)
None
IFA  A3000 (-3.1A)
IFA  A3000 (-4.1A)
 0.93A 1sn5B-3fc8A:
20.9
1sn5D-3fc8A:
21.0		 1sn5B-3fc8A:
55.12
1sn5D-3fc8A:
55.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fc8 TRANSTHYRETIN

(Homo sapiens) 		PF00576
(Transthyretin) 		6 LYS A  15
LEU A  17
GLU A  54
ALA A 108
LEU A 110
VAL A 121
 IFA  A3000 (-3.0A)
IFA  A3000 ( 4.7A)
None
IFA  A3000 (-3.1A)
IFA  A3000 (-4.1A)
None
 0.97A 1sn5B-3fc8A:
20.9
1sn5D-3fc8A:
21.0		 1sn5B-3fc8A:
55.12
1sn5D-3fc8A:
55.12
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.
3gei TRNA MODIFICATION
GTPASE MNME

(Chlorobaculum
tepidum) 		PF01926
(MMR_HSR1)
PF10396
(TrmE_N)
PF12631
(MnmE_helical) 		5 GLU A  95
ALA A  79
VAL A  77
LEU A  67
VAL A  37
 None
 1.08A 1sn5B-3geiA:
undetectable
1sn5D-3geiA:
undetectable		 1sn5B-3geiA:
14.35
1sn5D-3geiA:
14.35
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.
3gei TRNA MODIFICATION
GTPASE MNME

(Chlorobaculum
tepidum) 		PF01926
(MMR_HSR1)
PF10396
(TrmE_N)
PF12631
(MnmE_helical) 		5 LEU A  67
VAL A  37
GLU A  95
ALA A  79
VAL A  77
 None
 1.08A 1sn5B-3geiA:
undetectable
1sn5D-3geiA:
undetectable		 1sn5B-3geiA:
14.35
1sn5D-3geiA:
14.35
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.
3gyr PHENOXAZINONE
SYNTHASE

(Streptomyces
antibioticus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 LEU A 241
LEU A 308
LEU A 321
GLU A 407
VAL A 289
 None
 1.11A 1sn5B-3gyrA:
undetectable
1sn5D-3gyrA:
undetectable		 1sn5B-3gyrA:
14.26
1sn5D-3gyrA:
14.26
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.
3gyr PHENOXAZINONE
SYNTHASE

(Streptomyces
antibioticus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 LEU A 321
GLU A 407
VAL A 289
LEU A 241
LEU A 308
 None
 1.07A 1sn5B-3gyrA:
undetectable
1sn5D-3gyrA:
undetectable		 1sn5B-3gyrA:
14.26
1sn5D-3gyrA:
14.26
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.
3kat NACHT, LRR AND PYD
DOMAINS-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00619
(CARD) 		5 LEU A1400
LEU A1403
LYS A1428
LEU A1432
VAL A1396
 None
 1.04A 1sn5B-3katA:
undetectable
1sn5D-3katA:
undetectable		 1sn5B-3katA:
20.15
1sn5D-3katA:
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.
3kat NACHT, LRR AND PYD
DOMAINS-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00619
(CARD) 		5 LYS A1428
LEU A1432
VAL A1396
LEU A1400
LEU A1403
 None
 1.06A 1sn5B-3katA:
undetectable
1sn5D-3katA:
undetectable		 1sn5B-3katA:
20.15
1sn5D-3katA:
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.
3n26 AMINO ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN

(Chlamydia
pneumoniae) 		PF00497
(SBP_bac_3) 		5 LEU A  95
VAL A 243
LEU A 238
GLU A  66
VAL A  35
 None
 1.07A 1sn5B-3n26A:
undetectable
1sn5D-3n26A:
undetectable		 1sn5B-3n26A:
19.51
1sn5D-3n26A:
19.51
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.
3ozb METHYLTHIOADENOSINE
PHOSPHORYLASE

(Pseudomonas
aeruginosa) 		PF01048
(PNP_UDP_1) 		6 ALA A  86
LEU A  84
LEU A  51
GLU A  60
ALA A  19
LEU A  64
 None
None
None
SO4  A 262 (-3.1A)
None
None
 1.14A 1sn5B-3ozbA:
undetectable
1sn5D-3ozbA:
undetectable		 1sn5B-3ozbA:
21.88
1sn5D-3ozbA:
21.88
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.
3ozb METHYLTHIOADENOSINE
PHOSPHORYLASE

(Pseudomonas
aeruginosa) 		PF01048
(PNP_UDP_1) 		5 GLU A  60
ALA A  19
LEU A  64
LEU A 213
LEU A  84
 SO4  A 262 (-3.1A)
None
None
None
None
 1.05A 1sn5B-3ozbA:
undetectable
1sn5D-3ozbA:
undetectable		 1sn5B-3ozbA:
21.88
1sn5D-3ozbA:
21.88
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.
3ozb METHYLTHIOADENOSINE
PHOSPHORYLASE

(Pseudomonas
aeruginosa) 		PF01048
(PNP_UDP_1) 		6 LEU A  51
GLU A  60
ALA A  19
LEU A  64
ALA A  86
LEU A  84
 None
SO4  A 262 (-3.1A)
None
None
None
None
 1.14A 1sn5B-3ozbA:
undetectable
1sn5D-3ozbA:
undetectable		 1sn5B-3ozbA:
21.88
1sn5D-3ozbA:
21.88
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.
3ozb METHYLTHIOADENOSINE
PHOSPHORYLASE

(Pseudomonas
aeruginosa) 		PF01048
(PNP_UDP_1) 		5 LEU A 213
LEU A  84
GLU A  60
ALA A  19
LEU A  64
 None
None
SO4  A 262 (-3.1A)
None
None
 1.03A 1sn5B-3ozbA:
undetectable
1sn5D-3ozbA:
undetectable		 1sn5B-3ozbA:
21.88
1sn5D-3ozbA:
21.88
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.
3sma FRBF

(Streptomyces
rubellomurinus) 		PF02522
(Antibiotic_NAT) 		5 ALA A  46
LEU A  48
VAL A  44
LEU A  65
VAL A  22
 None
ACO  A 300 (-4.0A)
None
None
None
 1.05A 1sn5B-3smaA:
undetectable
1sn5D-3smaA:
undetectable		 1sn5B-3smaA:
18.25
1sn5D-3smaA:
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.
3sma FRBF

(Streptomyces
rubellomurinus) 		PF02522
(Antibiotic_NAT) 		5 LEU A  65
VAL A  22
ALA A  46
LEU A  48
VAL A  44
 None
None
None
ACO  A 300 (-4.0A)
None
 1.05A 1sn5B-3smaA:
undetectable
1sn5D-3smaA:
undetectable		 1sn5B-3smaA:
18.25
1sn5D-3smaA:
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.
3u0h XYLOSE ISOMERASE
DOMAIN PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF01261
(AP_endonuc_2) 		5 LEU A 156
LYS A 197
GLU A 196
ALA A 173
LEU A 137
 None
 1.06A 1sn5B-3u0hA:
undetectable
1sn5D-3u0hA:
undetectable		 1sn5B-3u0hA:
17.58
1sn5D-3u0hA:
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.
3u0h XYLOSE ISOMERASE
DOMAIN PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF01261
(AP_endonuc_2) 		5 LYS A 197
GLU A 196
ALA A 173
LEU A 137
LEU A 156
 None
 1.06A 1sn5B-3u0hA:
undetectable
1sn5D-3u0hA:
undetectable		 1sn5B-3u0hA:
17.58
1sn5D-3u0hA:
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.
3u9r METHYLCROTONYL-COA
CARBOXYLASE,
BETA-SUBUNIT

(Pseudomonas
aeruginosa) 		PF01039
(Carboxyl_trans) 		5 GLU B 333
VAL B 339
GLU B 346
ALA B 371
LEU B 399
 None
 1.12A 1sn5B-3u9rB:
undetectable
1sn5D-3u9rB:
undetectable		 1sn5B-3u9rB:
13.86
1sn5D-3u9rB:
13.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u9r METHYLCROTONYL-COA
CARBOXYLASE,
BETA-SUBUNIT

(Pseudomonas
aeruginosa) 		PF01039
(Carboxyl_trans) 		5 GLU B 346
ALA B 371
LEU B 399
GLU B 333
VAL B 339
 None
 1.15A 1sn5B-3u9rB:
undetectable
1sn5D-3u9rB:
undetectable		 1sn5B-3u9rB:
13.86
1sn5D-3u9rB:
13.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zuk ENDOPEPTIDASE,
PEPTIDASE FAMILY M13

(Mycobacterium
tuberculosis) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		5 GLU A 480
ALA A 574
LEU A 572
LEU A 364
ALA A 489
 None
PEG  A1681 (-3.7A)
None
None
None
 1.13A 1sn5B-3zukA:
undetectable
1sn5D-3zukA:
undetectable		 1sn5B-3zukA:
12.15
1sn5D-3zukA:
12.15
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.
3zuk ENDOPEPTIDASE,
PEPTIDASE FAMILY M13

(Mycobacterium
tuberculosis) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		5 LEU A 364
ALA A 489
GLU A 480
ALA A 574
LEU A 572
 None
None
None
PEG  A1681 (-3.7A)
None
 1.14A 1sn5B-3zukA:
undetectable
1sn5D-3zukA:
undetectable		 1sn5B-3zukA:
12.15
1sn5D-3zukA:
12.15
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.
4cta CINA-LIKE PROTEIN

(Thermus
thermophilus) 		PF00994
(MoCF_biosynth)
PF02464
(CinA) 		5 LEU A  50
GLU A  80
ALA A  85
LEU A 147
VAL A   9
 None
 1.04A 1sn5B-4ctaA:
undetectable
1sn5D-4ctaA:
undetectable		 1sn5B-4ctaA:
15.21
1sn5D-4ctaA:
15.21
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.
4cta CINA-LIKE PROTEIN

(Thermus
thermophilus) 		PF00994
(MoCF_biosynth)
PF02464
(CinA) 		5 LEU A 147
VAL A   9
LEU A  50
GLU A  80
ALA A  85
 None
 1.05A 1sn5B-4ctaA:
undetectable
1sn5D-4ctaA:
undetectable		 1sn5B-4ctaA:
15.21
1sn5D-4ctaA:
15.21
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.
4hgz CCBJ

(Streptomyces
caelestis) 		PF13649
(Methyltransf_25) 		5 GLU A  66
ALA A  57
VAL A  51
LEU A  80
ALA A  84
 None
 1.12A 1sn5B-4hgzA:
undetectable
1sn5D-4hgzA:
undetectable		 1sn5B-4hgzA:
18.28
1sn5D-4hgzA:
18.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hgz CCBJ

(Streptomyces
caelestis) 		PF13649
(Methyltransf_25) 		5 LEU A  80
ALA A  84
GLU A  66
ALA A  57
VAL A  51
 None
 1.11A 1sn5B-4hgzA:
undetectable
1sn5D-4hgzA:
undetectable		 1sn5B-4hgzA:
18.28
1sn5D-4hgzA:
18.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ifp MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NACHT, LRR
AND PYD
DOMAINS-CONTAINING
PROTEIN 1

(Escherichia
coli;
Homo sapiens) 		PF00619
(CARD)
PF13416
(SBP_bac_8) 		5 LEU A 393
LEU A 396
LYS A 421
LEU A 425
VAL A 389
 None
 0.95A 1sn5B-4ifpA:
undetectable
1sn5D-4ifpA:
undetectable		 1sn5B-4ifpA:
15.25
1sn5D-4ifpA:
15.25
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.
4ifp MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NACHT, LRR
AND PYD
DOMAINS-CONTAINING
PROTEIN 1

(Escherichia
coli;
Homo sapiens) 		PF00619
(CARD)
PF13416
(SBP_bac_8) 		5 LYS A 421
LEU A 425
VAL A 389
LEU A 393
LEU A 396
 None
 0.94A 1sn5B-4ifpA:
undetectable
1sn5D-4ifpA:
undetectable		 1sn5B-4ifpA:
15.25
1sn5D-4ifpA:
15.25
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.
4k92 CLIP-ASSOCIATING
PROTEIN 1

(Homo sapiens) 		PF12348
(CLASP_N) 		5 LEU A 369
GLU A 329
LEU A 366
LYS A 347
LEU A 351
 None
 1.11A 1sn5B-4k92A:
undetectable
1sn5D-4k92A:
undetectable		 1sn5B-4k92A:
19.06
1sn5D-4k92A:
19.06
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.
4k92 CLIP-ASSOCIATING
PROTEIN 1

(Homo sapiens) 		PF12348
(CLASP_N) 		5 LYS A 347
LEU A 351
LEU A 369
GLU A 329
LEU A 366
 None
 1.13A 1sn5B-4k92A:
undetectable
1sn5D-4k92A:
undetectable		 1sn5B-4k92A:
19.06
1sn5D-4k92A:
19.06
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.
4mh1 SORBOSE
DEHYDROGENASE

(Ketogulonicigenium
vulgare) 		PF13360
(PQQ_2) 		5 GLU A  38
LEU A  43
GLU A 491
ALA A 484
VAL A 472
 None
 1.03A 1sn5B-4mh1A:
undetectable
1sn5D-4mh1A:
undetectable		 1sn5B-4mh1A:
12.47
1sn5D-4mh1A:
12.47
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.
4mh1 SORBOSE
DEHYDROGENASE

(Ketogulonicigenium
vulgare) 		PF13360
(PQQ_2) 		5 GLU A 491
ALA A 484
VAL A 472
GLU A  38
LEU A  43
 None
 1.03A 1sn5B-4mh1A:
undetectable
1sn5D-4mh1A:
undetectable		 1sn5B-4mh1A:
12.47
1sn5D-4mh1A:
12.47
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.
4npr XYLOGLUCAN-SPECIFIC
ENDO-BETA-1,4-GLUCAN
ASE GH12

(Aspergillus
niveus) 		PF01670
(Glyco_hydro_12) 		5 LEU A 199
VAL A  96
LEU A 211
LEU A 122
VAL A 136
 None
 1.15A 1sn5B-4nprA:
undetectable
1sn5D-4nprA:
undetectable		 1sn5B-4nprA:
19.92
1sn5D-4nprA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q0g PROBABLE
ACETYL-/PROPIONYL-CO
A CARBOXYLASE (BETA
SUBUNIT) ACCD1

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		5 GLU A 299
VAL A 305
GLU A 312
ALA A 337
LEU A 365
 None
 1.01A 1sn5B-4q0gA:
undetectable
1sn5D-4q0gA:
undetectable		 1sn5B-4q0gA:
14.18
1sn5D-4q0gA:
14.18
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.
4q0g PROBABLE
ACETYL-/PROPIONYL-CO
A CARBOXYLASE (BETA
SUBUNIT) ACCD1

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		5 GLU A 312
ALA A 337
LEU A 365
GLU A 299
VAL A 305
 None
 1.03A 1sn5B-4q0gA:
undetectable
1sn5D-4q0gA:
undetectable		 1sn5B-4q0gA:
14.18
1sn5D-4q0gA:
14.18
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.
4q98 MAJOR FIMBRIAL
SUBUNIT PROTEIN

(Porphyromonas
gingivalis) 		PF06321
(P_gingi_FimA)
PF15495
(Fimbrillin_C) 		5 LEU A  97
LEU A 168
LYS A  73
ALA A  61
VAL A  63
 None
 1.14A 1sn5B-4q98A:
4.7
1sn5D-4q98A:
4.6		 1sn5B-4q98A:
16.03
1sn5D-4q98A:
16.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r81 NADH DEHYDROGENASE

(Methanothermobacter
marburgensis) 		PF02525
(Flavodoxin_2) 		5 LEU A 130
ALA A  83
LEU A 196
ALA A 192
LEU A  27
 None
 1.09A 1sn5B-4r81A:
undetectable
1sn5D-4r81A:
undetectable		 1sn5B-4r81A:
19.32
1sn5D-4r81A:
19.32
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.
4r81 NADH DEHYDROGENASE

(Methanothermobacter
marburgensis) 		PF02525
(Flavodoxin_2) 		5 LEU A 196
ALA A 192
LEU A  27
LEU A 130
ALA A  83
 None
 1.10A 1sn5B-4r81A:
undetectable
1sn5D-4r81A:
undetectable		 1sn5B-4r81A:
19.32
1sn5D-4r81A:
19.32
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.
4rhy HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Mycobacterium
tuberculosis) 		PF00156
(Pribosyltran) 		5 LEU A 119
VAL A 125
LEU A 131
GLU A 163
LEU A 134
 LEU  A 119 ( 0.6A)
VAL  A 125 (-0.6A)
LEU  A 131 ( 0.6A)
GLU  A 163 ( 0.6A)
LEU  A 134 ( 0.6A)
 1.09A 1sn5B-4rhyA:
undetectable
1sn5D-4rhyA:
undetectable		 1sn5B-4rhyA:
21.05
1sn5D-4rhyA:
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.
4rhy HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Mycobacterium
tuberculosis) 		PF00156
(Pribosyltran) 		5 LEU A 131
GLU A 163
LEU A 134
LEU A 119
VAL A 125
 LEU  A 131 ( 0.6A)
GLU  A 163 ( 0.6A)
LEU  A 134 ( 0.6A)
LEU  A 119 ( 0.6A)
VAL  A 125 (-0.6A)
 1.10A 1sn5B-4rhyA:
undetectable
1sn5D-4rhyA:
undetectable		 1sn5B-4rhyA:
21.05
1sn5D-4rhyA:
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.
4toc BACTERIOFERRITIN

(Pseudomonas
aeruginosa) 		PF00210
(Ferritin) 		5 GLU A 109
ALA A 104
LEU A 101
VAL A   7
LEU A  11
 None
 1.13A 1sn5B-4tocA:
undetectable
1sn5D-4tocA:
undetectable		 1sn5B-4tocA:
19.75
1sn5D-4tocA:
19.75
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.
4trt DNA POLYMERASE III
SUBUNIT BETA

(Deinococcus
radiodurans) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 LEU A  43
VAL A  70
LEU A  96
LEU A  91
VAL A   6
 None
 1.09A 1sn5B-4trtA:
undetectable
1sn5D-4trtA:
undetectable		 1sn5B-4trtA:
17.07
1sn5D-4trtA:
17.07
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.
4trt DNA POLYMERASE III
SUBUNIT BETA

(Deinococcus
radiodurans) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 LEU A  96
LEU A  91
VAL A   6
LEU A  43
VAL A  70
 None
 1.12A 1sn5B-4trtA:
undetectable
1sn5D-4trtA:
undetectable		 1sn5B-4trtA:
17.07
1sn5D-4trtA:
17.07
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.
4v3q YIII_M4_AII

(synthetic
construct) 		PF00514
(Arm)
PF16186
(Arm_3) 		5 LEU A 181
GLU A 219
ALA A 222
LEU A 184
LEU A 248
 None
 0.98A 1sn5B-4v3qA:
undetectable
1sn5D-4v3qA:
undetectable		 1sn5B-4v3qA:
21.43
1sn5D-4v3qA:
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.
4v3q YIII_M4_AII

(synthetic
construct) 		PF00514
(Arm)
PF16186
(Arm_3) 		5 LEU A 248
LEU A 181
GLU A 219
ALA A 222
LEU A 184
 None
 0.95A 1sn5B-4v3qA:
undetectable
1sn5D-4v3qA:
undetectable		 1sn5B-4v3qA:
21.43
1sn5D-4v3qA:
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.
4xk2 ALDO/KETO REDUCTASE

(Polaromonas sp.
JS666) 		PF00248
(Aldo_ket_red) 		5 LEU A 220
VAL A 211
LEU A 277
LEU A 274
VAL A 254
 None
 1.07A 1sn5B-4xk2A:
undetectable
1sn5D-4xk2A:
undetectable		 1sn5B-4xk2A:
18.54
1sn5D-4xk2A:
18.54
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.
4xk2 ALDO/KETO REDUCTASE

(Polaromonas sp.
JS666) 		PF00248
(Aldo_ket_red) 		5 LEU A 277
LEU A 274
VAL A 254
LEU A 220
VAL A 211
 None
 1.07A 1sn5B-4xk2A:
undetectable
1sn5D-4xk2A:
undetectable		 1sn5B-4xk2A:
18.54
1sn5D-4xk2A:
18.54
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.
4ynn PROTEASE DO

(Legionella
pneumophila) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 ALA A 101
LEU A 103
LEU A  88
GLU A  61
ALA A  86
 None
 1.09A 1sn5B-4ynnA:
undetectable
1sn5D-4ynnA:
undetectable		 1sn5B-4ynnA:
18.71
1sn5D-4ynnA:
18.71
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.
4ynn PROTEASE DO

(Legionella
pneumophila) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 LEU A  88
GLU A  61
ALA A  86
ALA A 101
LEU A 103
 None
 1.08A 1sn5B-4ynnA:
undetectable
1sn5D-4ynnA:
undetectable		 1sn5B-4ynnA:
18.71
1sn5D-4ynnA:
18.71
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.
5ces PA0618

(Pseudomonas
aeruginosa) 		no annotation 6 LEU A 233
ALA A 229
VAL A 261
LEU A 214
ALA A 212
VAL A 210
 None
 1.35A 1sn5B-5cesA:
undetectable
1sn5D-5cesA:
undetectable		 1sn5B-5cesA:
23.26
1sn5D-5cesA:
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.
5cs0 ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF08326
(ACC_central) 		5 LEU A 854
LEU A 858
VAL A 866
LEU A 881
LEU A 884
 None
 1.14A 1sn5B-5cs0A:
undetectable
1sn5D-5cs0A:
undetectable		 1sn5B-5cs0A:
16.87
1sn5D-5cs0A:
16.87
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.
5d28 GM-CSF/IL-2
INHIBITION FACTOR

(Orf virus) 		no annotation 5 ALA A  87
LEU A  40
ALA A 212
LEU A 214
VAL A 210
 None
 1.02A 1sn5B-5d28A:
undetectable
1sn5D-5d28A:
undetectable		 1sn5B-5d28A:
17.72
1sn5D-5d28A:
17.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d28 GM-CSF/IL-2
INHIBITION FACTOR

(Orf virus) 		no annotation 5 LEU A  40
ALA A 212
LEU A 214
VAL A 210
ALA A  87
 None
 1.02A 1sn5B-5d28A:
undetectable
1sn5D-5d28A:
undetectable		 1sn5B-5d28A:
17.72
1sn5D-5d28A:
17.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fql IDURONATE-2-SULFATAS
E

(Homo sapiens) 		PF00884
(Sulfatase) 		5 LEU A 413
LEU A 410
VAL A 401
LEU A 359
VAL A 363
 None
 0.96A 1sn5B-5fqlA:
undetectable
1sn5D-5fqlA:
undetectable		 1sn5B-5fqlA:
12.50
1sn5D-5fqlA:
12.50
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.
5i8e VRC34.01 FAB HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA A 136
VAL A 184
LEU A 138
GLU A 212
ALA A 125
 None
 1.00A 1sn5B-5i8eA:
3.6
1sn5D-5i8eA:
undetectable		 1sn5B-5i8eA:
20.78
1sn5D-5i8eA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i8e VRC34.01 FAB HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 LEU A 138
GLU A 212
ALA A 125
ALA A 136
VAL A 184
 None
 1.01A 1sn5B-5i8eA:
3.6
1sn5D-5i8eA:
undetectable		 1sn5B-5i8eA:
20.78
1sn5D-5i8eA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jp3 XANTHOMONAS OUTER
PROTEIN D

(Xanthomonas
euvesicatoria) 		PF02902
(Peptidase_C48) 		5 LEU A 401
VAL A 423
LEU A 451
ALA A 445
VAL A 372
 None
 1.09A 1sn5B-5jp3A:
undetectable
1sn5D-5jp3A:
undetectable		 1sn5B-5jp3A:
16.67
1sn5D-5jp3A:
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.
5jp3 XANTHOMONAS OUTER
PROTEIN D

(Xanthomonas
euvesicatoria) 		PF02902
(Peptidase_C48) 		5 LEU A 451
ALA A 445
VAL A 372
LEU A 401
VAL A 423
 None
 1.09A 1sn5B-5jp3A:
undetectable
1sn5D-5jp3A:
undetectable		 1sn5B-5jp3A:
16.67
1sn5D-5jp3A:
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.
5lji FLAVODOXIN

(Streptococcus
pneumoniae) 		PF00258
(Flavodoxin_1) 		5 LYS A   5
ALA A  52
LEU A  80
ALA A  43
VAL A  41
 None
 1.09A 1sn5B-5ljiA:
undetectable
1sn5D-5ljiA:
undetectable		 1sn5B-5ljiA:
20.53
1sn5D-5ljiA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 LEU A4585
LEU A4563
VAL A4640
LEU A4607
VAL A4545
 None
 0.74A 1sn5B-5nugA:
undetectable
1sn5D-5nugA:
undetectable		 1sn5B-5nugA:
2.50
1sn5D-5nugA:
2.50
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 LEU A4607
VAL A4545
LEU A4585
LEU A4563
VAL A4640
 None
 0.72A 1sn5B-5nugA:
undetectable
1sn5D-5nugA:
undetectable		 1sn5B-5nugA:
2.50
1sn5D-5nugA:
2.50
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.
5una 7SK SNRNA
METHYLPHOSPHATE
CAPPING ENZYME

(Homo sapiens) 		PF06859
(Bin3)
PF13847
(Methyltransf_31) 		5 LEU A 579
VAL A 664
LEU A 680
GLU A 440
VAL A 447
 None
 0.96A 1sn5B-5unaA:
undetectable
1sn5D-5unaA:
undetectable		 1sn5B-5unaA:
18.88
1sn5D-5unaA:
18.88
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.
5una 7SK SNRNA
METHYLPHOSPHATE
CAPPING ENZYME

(Homo sapiens) 		PF06859
(Bin3)
PF13847
(Methyltransf_31) 		5 LEU A 680
GLU A 440
VAL A 447
LEU A 579
VAL A 664
 None
 0.98A 1sn5B-5unaA:
undetectable
1sn5D-5unaA:
undetectable		 1sn5B-5unaA:
18.88
1sn5D-5unaA:
18.88
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.
5wat HOMOSERINE KINASE

(Corynebacterium
glutamicum) 		no annotation 5 GLU A 172
ALA A 149
VAL A 151
LEU A  29
LEU A  22
 None
 1.13A 1sn5B-5watA:
undetectable
1sn5D-5watA:
undetectable		 1sn5B-5watA:
23.39
1sn5D-5watA:
23.39
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.
5wat HOMOSERINE KINASE

(Corynebacterium
glutamicum) 		no annotation 5 LEU A  29
LEU A  22
GLU A 172
ALA A 149
VAL A 151
 None
 1.11A 1sn5B-5watA:
undetectable
1sn5D-5watA:
undetectable		 1sn5B-5watA:
23.39
1sn5D-5watA:
23.39
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.
5xwb 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Colwellia
psychrerythraea) 		PF00275
(EPSP_synthase) 		5 ALA A 176
LEU A 174
LEU A 129
ALA A 132
VAL A 163
 None
 1.15A 1sn5B-5xwbA:
undetectable
1sn5D-5xwbA:
undetectable		 1sn5B-5xwbA:
16.11
1sn5D-5xwbA:
16.11
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.
5xwb 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Colwellia
psychrerythraea) 		PF00275
(EPSP_synthase) 		5 LEU A 129
ALA A 132
VAL A 163
ALA A 176
LEU A 174
 None
 1.13A 1sn5B-5xwbA:
undetectable
1sn5D-5xwbA:
undetectable		 1sn5B-5xwbA:
16.11
1sn5D-5xwbA:
16.11