SIMILAR PATTERNS OF AMINO ACIDS FOR 4Z90_E_4LEE401

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.
1as4 ANTICHYMOTRYPSIN

(Homo sapiens) 		PF00079
(Serpin) 		4 THR A 102
LEU A 103
LEU A  99
THR B 379
 None
 0.89A 4z90A-1as4A:
1.0
4z90B-1as4A:
1.0
4z90C-1as4A:
0.9
4z90D-1as4A:
1.0
4z90E-1as4A:
0.8		 4z90A-1as4A:
22.37
4z90B-1as4A:
22.37
4z90C-1as4A:
22.37
4z90D-1as4A:
22.37
4z90E-1as4A:
22.37
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.
1azw PROLINE
IMINOPEPTIDASE

(Xanthomonas
citri) 		PF00561
(Abhydrolase_1) 		4 THR A  85
LEU A  88
THR A 114
LEU A 115
 None
 0.77A 4z90A-1azwA:
0.0
4z90B-1azwA:
0.0
4z90C-1azwA:
0.0
4z90D-1azwA:
0.0
4z90E-1azwA:
0.0		 4z90A-1azwA:
21.94
4z90B-1azwA:
21.94
4z90C-1azwA:
21.94
4z90D-1azwA:
21.94
4z90E-1azwA:
21.94
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.
1d6m DNA TOPOISOMERASE
III

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01751
(Toprim) 		4 THR A 598
LEU A 599
LEU A 595
THR A 571
 None
 0.89A 4z90A-1d6mA:
0.0
4z90B-1d6mA:
0.0
4z90C-1d6mA:
0.0
4z90D-1d6mA:
0.0
4z90E-1d6mA:
0.0		 4z90A-1d6mA:
20.74
4z90B-1d6mA:
20.74
4z90C-1d6mA:
20.74
4z90D-1d6mA:
20.74
4z90E-1d6mA:
20.74
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.
1fhe GLUTATHIONE
TRANSFERASE

(Fasciola
hepatica) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 THR A 157
LEU A 158
LEU A 154
THR A 128
 None
 0.90A 4z90A-1fheA:
2.0
4z90B-1fheA:
2.0
4z90C-1fheA:
2.4
4z90D-1fheA:
2.3
4z90E-1fheA:
2.3		 4z90A-1fheA:
21.32
4z90B-1fheA:
21.32
4z90C-1fheA:
21.32
4z90D-1fheA:
21.32
4z90E-1fheA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ig0 THIAMIN
PYROPHOSPHOKINASE

(Saccharomyces
cerevisiae) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		4 THR A 208
LEU A 209
THR A 204
THR A 128
 None
 0.94A 4z90A-1ig0A:
0.0
4z90B-1ig0A:
0.0
4z90C-1ig0A:
0.0
4z90D-1ig0A:
0.0
4z90E-1ig0A:
0.0		 4z90A-1ig0A:
22.02
4z90B-1ig0A:
22.02
4z90C-1ig0A:
22.02
4z90D-1ig0A:
22.02
4z90E-1ig0A:
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.
1kbz DTDP-GLUCOSE
OXIDOREDUCTASE

(Salmonella
enterica) 		PF04321
(RmlD_sub_bind) 		4 LEU A 279
THR A 187
LEU A 191
THR A 268
 None
 0.85A 4z90A-1kbzA:
0.0
4z90B-1kbzA:
0.0
4z90C-1kbzA:
0.0
4z90D-1kbzA:
0.0
4z90E-1kbzA:
0.0		 4z90A-1kbzA:
19.54
4z90B-1kbzA:
19.54
4z90C-1kbzA:
19.54
4z90D-1kbzA:
19.54
4z90E-1kbzA:
19.54
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.
1pch PHOSPHOCARRIER
PROTEIN

(Mycoplasma
capricolum) 		PF00381
(PTS-HPr) 		4 LEU A  14
THR A  84
LEU A  86
THR A  80
 None
 0.86A 4z90A-1pchA:
undetectable
4z90B-1pchA:
undetectable
4z90C-1pchA:
undetectable
4z90D-1pchA:
undetectable
4z90E-1pchA:
undetectable		 4z90A-1pchA:
14.11
4z90B-1pchA:
14.11
4z90C-1pchA:
14.11
4z90D-1pchA:
14.11
4z90E-1pchA:
14.11
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.
1pzn DNA REPAIR AND
RECOMBINATION
PROTEIN RAD51

(Pyrococcus
furiosus) 		PF08423
(Rad51)
PF14520
(HHH_5) 		4 THR A 176
THR A 173
THR A 282
THR A 145
 None
None
None
SO4  A 350 (-3.5A)
 0.87A 4z90A-1pznA:
undetectable
4z90B-1pznA:
undetectable
4z90C-1pznA:
undetectable
4z90D-1pznA:
undetectable
4z90E-1pznA:
undetectable		 4z90A-1pznA:
21.45
4z90B-1pznA:
21.45
4z90C-1pznA:
21.45
4z90D-1pznA:
21.45
4z90E-1pznA:
21.45
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.
1q5a EP-CADHERIN

(Mus musculus) 		PF00028
(Cadherin) 		4 THR A 407
THR A 425
LEU A 426
THR A 405
 NAG  A 808 (-2.2A)
NDG  A 811 (-2.2A)
None
NAG  A 808 ( 4.5A)
 0.65A 4z90A-1q5aA:
undetectable
4z90B-1q5aA:
undetectable
4z90C-1q5aA:
undetectable
4z90D-1q5aA:
undetectable
4z90E-1q5aA:
undetectable		 4z90A-1q5aA:
16.50
4z90B-1q5aA:
16.50
4z90C-1q5aA:
16.50
4z90D-1q5aA:
16.50
4z90E-1q5aA:
16.50
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.
1qo4 PEROXIDASE

(Arabidopsis
thaliana) 		PF00141
(peroxidase) 		4 THR A 159
LEU A 162
THR A 252
THR A 149
 None
 0.85A 4z90A-1qo4A:
undetectable
4z90B-1qo4A:
undetectable
4z90C-1qo4A:
undetectable
4z90D-1qo4A:
undetectable
4z90E-1qo4A:
undetectable		 4z90A-1qo4A:
19.46
4z90B-1qo4A:
19.46
4z90C-1qo4A:
19.46
4z90D-1qo4A:
19.46
4z90E-1qo4A:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1smo TRIGGERING RECEPTOR
EXPRESSED ON MYELOID
CELLS 1

(Homo sapiens) 		PF07686
(V-set) 		4 THR A  70
LEU A  87
LEU A  96
THR A  66
 None
 0.93A 4z90A-1smoA:
undetectable
4z90B-1smoA:
undetectable
4z90C-1smoA:
undetectable
4z90D-1smoA:
undetectable
4z90E-1smoA:
undetectable		 4z90A-1smoA:
14.11
4z90B-1smoA:
14.11
4z90C-1smoA:
14.11
4z90D-1smoA:
14.11
4z90E-1smoA:
14.11
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.
1szp DNA REPAIR PROTEIN
RAD51

(Saccharomyces
cerevisiae) 		PF08423
(Rad51)
PF14520
(HHH_5) 		4 THR A 197
LEU A 198
LEU A 194
THR A 201
 None
 0.92A 4z90A-1szpA:
undetectable
4z90B-1szpA:
undetectable
4z90C-1szpA:
undetectable
4z90D-1szpA:
undetectable
4z90E-1szpA:
undetectable		 4z90A-1szpA:
21.21
4z90B-1szpA:
21.21
4z90C-1szpA:
21.21
4z90D-1szpA:
21.21
4z90E-1szpA:
21.21
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.
1t33 PUTATIVE
TRANSCRIPTIONAL
REPRESSOR (TETR/ACRR
FAMILY)

(Salmonella
enterica) 		PF00440
(TetR_N)
PF09209
(DUF1956) 		5 LEU A 215
THR A 169
LEU A 172
THR A 149
THR A 156
 None
 1.48A 4z90A-1t33A:
3.4
4z90B-1t33A:
3.1
4z90C-1t33A:
3.5
4z90D-1t33A:
3.5
4z90E-1t33A:
3.5		 4z90A-1t33A:
21.73
4z90B-1t33A:
21.73
4z90C-1t33A:
21.73
4z90D-1t33A:
21.73
4z90E-1t33A:
21.73
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.
1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE

(Shewanella
massilia) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		4 LEU A 313
LEU A 242
THR A 182
THR A 316
 None
 0.90A 4z90A-1tmoA:
undetectable
4z90B-1tmoA:
undetectable
4z90C-1tmoA:
undetectable
4z90D-1tmoA:
undetectable
4z90E-1tmoA:
undetectable		 4z90A-1tmoA:
17.59
4z90B-1tmoA:
17.59
4z90C-1tmoA:
17.59
4z90D-1tmoA:
17.59
4z90E-1tmoA:
17.59
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.
1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE

(Shewanella
massilia) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		4 THR A 316
LEU A 317
LEU A 313
THR A 182
 None
 0.92A 4z90A-1tmoA:
undetectable
4z90B-1tmoA:
undetectable
4z90C-1tmoA:
undetectable
4z90D-1tmoA:
undetectable
4z90E-1tmoA:
undetectable		 4z90A-1tmoA:
17.59
4z90B-1tmoA:
17.59
4z90C-1tmoA:
17.59
4z90D-1tmoA:
17.59
4z90E-1tmoA:
17.59
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.
1ul1 FLAP ENDONUCLEASE-1

(Homo sapiens) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		4 LEU X 190
THR X 184
LEU X 183
THR X 177
 None
 0.86A 4z90A-1ul1X:
undetectable
4z90B-1ul1X:
undetectable
4z90C-1ul1X:
undetectable
4z90D-1ul1X:
undetectable
4z90E-1ul1X:
undetectable		 4z90A-1ul1X:
21.99
4z90B-1ul1X:
21.99
4z90C-1ul1X:
21.99
4z90D-1ul1X:
21.99
4z90E-1ul1X:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wzz PROBABLE
ENDOGLUCANASE

(Komagataeibacter
xylinus) 		PF01270
(Glyco_hydro_8) 		4 THR A 329
LEU A 330
THR A 316
LEU A 317
 None
 0.94A 4z90A-1wzzA:
undetectable
4z90B-1wzzA:
undetectable
4z90C-1wzzA:
undetectable
4z90D-1wzzA:
undetectable
4z90E-1wzzA:
undetectable		 4z90A-1wzzA:
22.43
4z90B-1wzzA:
22.43
4z90C-1wzzA:
22.43
4z90D-1wzzA:
22.43
4z90E-1wzzA:
22.43
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.
1x2b PROLINE
IMINOPEPTIDASE

(Serratia
marcescens) 		PF00561
(Abhydrolase_1) 		4 THR A  88
LEU A  91
THR A 117
LEU A 118
 None
 0.93A 4z90A-1x2bA:
undetectable
4z90B-1x2bA:
undetectable
4z90C-1x2bA:
undetectable
4z90D-1x2bA:
undetectable
4z90E-1x2bA:
undetectable		 4z90A-1x2bA:
22.16
4z90B-1x2bA:
22.16
4z90C-1x2bA:
22.16
4z90D-1x2bA:
22.16
4z90E-1x2bA:
22.16
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.
1xco PHOSPHATE
ACETYLTRANSFERASE

(Bacillus
subtilis) 		PF01515
(PTA_PTB) 		4 LEU A 137
THR A 132
THR A 129
THR A 149
 None
None
UVW  A 418 (-4.1A)
None
 0.92A 4z90A-1xcoA:
undetectable
4z90B-1xcoA:
undetectable
4z90C-1xcoA:
undetectable
4z90D-1xcoA:
undetectable
4z90E-1xcoA:
undetectable		 4z90A-1xcoA:
21.20
4z90B-1xcoA:
21.20
4z90C-1xcoA:
21.20
4z90D-1xcoA:
21.20
4z90E-1xcoA:
21.20
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.
1ypz H2-T22 PROTEIN
T CELL RECEPTOR
DELTA

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set)
PF07686
(V-set) 		4 THR A  80
LEU A  81
LEU E 101
THR E 103
 None
 0.92A 4z90A-1ypzA:
undetectable
4z90B-1ypzA:
undetectable
4z90C-1ypzA:
undetectable
4z90D-1ypzA:
undetectable
4z90E-1ypzA:
undetectable		 4z90A-1ypzA:
23.73
4z90B-1ypzA:
23.73
4z90C-1ypzA:
23.73
4z90D-1ypzA:
23.73
4z90E-1ypzA:
23.73
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.
1yzh TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Streptococcus
pneumoniae) 		PF02390
(Methyltransf_4) 		4 THR A 131
LEU A 130
LEU A 114
THR A 153
 None
 0.90A 4z90A-1yzhA:
undetectable
4z90B-1yzhA:
undetectable
4z90C-1yzhA:
undetectable
4z90D-1yzhA:
undetectable
4z90E-1yzhA:
undetectable		 4z90A-1yzhA:
21.76
4z90B-1yzhA:
21.76
4z90C-1yzhA:
21.76
4z90D-1yzhA:
21.76
4z90E-1yzhA:
21.76
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.
2dpn GLYCEROL KINASE

(Thermus
thermophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 LEU A 229
THR A  54
LEU A  55
THR A 225
 None
 0.85A 4z90A-2dpnA:
undetectable
4z90B-2dpnA:
undetectable
4z90C-2dpnA:
undetectable
4z90D-2dpnA:
undetectable
4z90E-2dpnA:
undetectable		 4z90A-2dpnA:
20.83
4z90B-2dpnA:
20.83
4z90C-2dpnA:
20.83
4z90D-2dpnA:
20.83
4z90E-2dpnA:
20.83
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.
2fca TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Bacillus
subtilis) 		PF02390
(Methyltransf_4) 		4 THR A 131
LEU A 130
LEU A 114
THR A 153
 None
 0.92A 4z90A-2fcaA:
undetectable
4z90B-2fcaA:
undetectable
4z90C-2fcaA:
undetectable
4z90D-2fcaA:
undetectable
4z90E-2fcaA:
undetectable		 4z90A-2fcaA:
20.18
4z90B-2fcaA:
20.18
4z90C-2fcaA:
20.18
4z90D-2fcaA:
20.18
4z90E-2fcaA:
20.18
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.
2fon PEROXISOMAL ACYL-COA
OXIDASE 1A

(Solanum
lycopersicum) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		4 THR A 377
LEU A 380
LEU A 351
THR A 454
 None
 0.93A 4z90A-2fonA:
2.7
4z90B-2fonA:
2.9
4z90C-2fonA:
3.2
4z90D-2fonA:
3.2
4z90E-2fonA:
2.7		 4z90A-2fonA:
19.30
4z90B-2fonA:
19.30
4z90C-2fonA:
19.30
4z90D-2fonA:
19.30
4z90E-2fonA:
19.30
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.
2gau TRANSCRIPTIONAL
REGULATOR, CRP/FNR
FAMILY

(Porphyromonas
gingivalis) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		4 LEU A 161
THR A 228
LEU A 225
THR A 200
 None
 0.77A 4z90A-2gauA:
undetectable
4z90B-2gauA:
undetectable
4z90C-2gauA:
undetectable
4z90D-2gauA:
undetectable
4z90E-2gauA:
undetectable		 4z90A-2gauA:
21.74
4z90B-2gauA:
21.74
4z90C-2gauA:
21.74
4z90D-2gauA:
21.74
4z90E-2gauA:
21.74
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.
2gau TRANSCRIPTIONAL
REGULATOR, CRP/FNR
FAMILY

(Porphyromonas
gingivalis) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		4 LEU A 225
LEU A 210
THR A 200
THR A 228
 None
 0.74A 4z90A-2gauA:
undetectable
4z90B-2gauA:
undetectable
4z90C-2gauA:
undetectable
4z90D-2gauA:
undetectable
4z90E-2gauA:
undetectable		 4z90A-2gauA:
21.74
4z90B-2gauA:
21.74
4z90C-2gauA:
21.74
4z90D-2gauA:
21.74
4z90E-2gauA:
21.74
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.
2gau TRANSCRIPTIONAL
REGULATOR, CRP/FNR
FAMILY

(Porphyromonas
gingivalis) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		4 LEU A 225
LEU A 210
THR A 203
THR A 228
 None
 0.93A 4z90A-2gauA:
undetectable
4z90B-2gauA:
undetectable
4z90C-2gauA:
undetectable
4z90D-2gauA:
undetectable
4z90E-2gauA:
undetectable		 4z90A-2gauA:
21.74
4z90B-2gauA:
21.74
4z90C-2gauA:
21.74
4z90D-2gauA:
21.74
4z90E-2gauA:
21.74
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.
2gie TYPE II RESTRICTION
ENZYME HINCII

(Haemophilus
influenzae) 		PF09226
(Endonuc-HincII) 		4 LEU A  89
THR A  84
LEU A  85
THR A 112
 None
 0.87A 4z90A-2gieA:
undetectable
4z90B-2gieA:
undetectable
4z90C-2gieA:
undetectable
4z90D-2gieA:
undetectable
4z90E-2gieA:
undetectable		 4z90A-2gieA:
22.32
4z90B-2gieA:
22.32
4z90C-2gieA:
22.32
4z90D-2gieA:
22.32
4z90E-2gieA:
22.32
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.
2ipi ACLACINOMYCIN
OXIDOREDUCTASE
(AKNOX)

(Streptomyces
galilaeus) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		4 THR A 329
LEU A 330
LEU A 326
THR A 113
 None
 0.93A 4z90A-2ipiA:
undetectable
4z90B-2ipiA:
undetectable
4z90C-2ipiA:
undetectable
4z90D-2ipiA:
undetectable
4z90E-2ipiA:
undetectable		 4z90A-2ipiA:
20.72
4z90B-2ipiA:
20.72
4z90C-2ipiA:
20.72
4z90D-2ipiA:
20.72
4z90E-2ipiA:
20.72
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.
2jem ENDO-BETA-1,4-GLUCAN
ASE

(Bacillus
licheniformis) 		PF01670
(Glyco_hydro_12) 		4 LEU A 140
THR A 232
LEU A 112
THR A 153
 None
 0.94A 4z90A-2jemA:
undetectable
4z90B-2jemA:
undetectable
4z90C-2jemA:
undetectable
4z90D-2jemA:
undetectable
4z90E-2jemA:
undetectable		 4z90A-2jemA:
21.54
4z90B-2jemA:
21.54
4z90C-2jemA:
21.54
4z90D-2jemA:
21.54
4z90E-2jemA:
21.54
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.
2jsw TALIN-1

(Mus musculus) 		PF01608
(I_LWEQ) 		4 THR A2435
LEU A2438
THR A2356
LEU A2359
 None
 0.84A 4z90A-2jswA:
3.6
4z90B-2jswA:
3.6
4z90C-2jswA:
3.0
4z90D-2jswA:
3.0
4z90E-2jswA:
3.0		 4z90A-2jswA:
18.92
4z90B-2jswA:
18.92
4z90C-2jswA:
18.92
4z90D-2jswA:
18.92
4z90E-2jswA:
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.
2nrj HBL B PROTEIN

(Bacillus cereus) 		PF05791
(Bacillus_HBL) 		4 THR A  91
LEU A  92
LEU A  88
THR A  25
 None
 0.80A 4z90A-2nrjA:
3.6
4z90B-2nrjA:
3.9
4z90C-2nrjA:
3.6
4z90D-2nrjA:
3.5
4z90E-2nrjA:
3.5		 4z90A-2nrjA:
23.33
4z90B-2nrjA:
23.33
4z90C-2nrjA:
23.33
4z90D-2nrjA:
23.33
4z90E-2nrjA:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o1s 1-DEOXY-D-XYLULOSE-5
-PHOSPHATE SYNTHASE

(Escherichia
coli) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
PF13292
(DXP_synthase_N) 		4 THR A  17
LEU A  20
THR A  69
THR A  60
 None
 0.92A 4z90A-2o1sA:
undetectable
4z90B-2o1sA:
undetectable
4z90C-2o1sA:
undetectable
4z90D-2o1sA:
undetectable
4z90E-2o1sA:
undetectable		 4z90A-2o1sA:
19.04
4z90B-2o1sA:
19.04
4z90C-2o1sA:
19.04
4z90D-2o1sA:
19.04
4z90E-2o1sA:
19.04
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.
2o5p FERRIPYOVERDINE
RECEPTOR

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07660
(STN)
PF07715
(Plug) 		5 THR A 156
LEU A 158
THR A 165
LEU A 160
THR A 534
 None
 1.39A 4z90A-2o5pA:
undetectable
4z90B-2o5pA:
undetectable
4z90C-2o5pA:
undetectable
4z90D-2o5pA:
undetectable
4z90E-2o5pA:
undetectable		 4z90A-2o5pA:
18.18
4z90B-2o5pA:
18.18
4z90C-2o5pA:
18.18
4z90D-2o5pA:
18.18
4z90E-2o5pA:
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.
2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC

(Homo sapiens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 THR A 402
LEU A 357
LEU A 365
THR A 389
 None
 0.85A 4z90A-2p8uA:
undetectable
4z90B-2p8uA:
undetectable
4z90C-2p8uA:
undetectable
4z90D-2p8uA:
undetectable
4z90E-2p8uA:
undetectable		 4z90A-2p8uA:
20.87
4z90B-2p8uA:
20.87
4z90C-2p8uA:
20.87
4z90D-2p8uA:
20.87
4z90E-2p8uA:
20.87
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.
2q07 UNCHARACTERIZED
PROTEIN AF0587

(Archaeoglobus
fulgidus) 		PF01472
(PUA) 		4 THR A 277
LEU A 281
LEU A 264
THR A 350
 None
 0.90A 4z90A-2q07A:
undetectable
4z90B-2q07A:
undetectable
4z90C-2q07A:
undetectable
4z90D-2q07A:
undetectable
4z90E-2q07A:
undetectable		 4z90A-2q07A:
21.49
4z90B-2q07A:
21.49
4z90C-2q07A:
21.49
4z90D-2q07A:
21.49
4z90E-2q07A:
21.49
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.
2v6g PROGESTERONE
5-BETA-REDUCTASE

(Digitalis
lanata) 		PF01370
(Epimerase) 		4 THR A 220
LEU A 221
LEU A 217
THR A 238
 None
 0.91A 4z90A-2v6gA:
undetectable
4z90B-2v6gA:
undetectable
4z90C-2v6gA:
undetectable
4z90D-2v6gA:
undetectable
4z90E-2v6gA:
undetectable		 4z90A-2v6gA:
21.37
4z90B-2v6gA:
21.37
4z90C-2v6gA:
21.37
4z90D-2v6gA:
21.37
4z90E-2v6gA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w1j PUTATIVE SORTASE

(Streptococcus
pneumoniae) 		PF04203
(Sortase) 		5 LEU A 179
THR A 129
LEU A 191
THR A 100
THR A 115
 None
 1.30A 4z90A-2w1jA:
undetectable
4z90B-2w1jA:
undetectable
4z90C-2w1jA:
undetectable
4z90D-2w1jA:
undetectable
4z90E-2w1jA:
undetectable		 4z90A-2w1jA:
20.25
4z90B-2w1jA:
20.25
4z90C-2w1jA:
20.25
4z90D-2w1jA:
20.25
4z90E-2w1jA:
20.25
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.
2xqy ENVELOPE
GLYCOPROTEIN H

(Suid
alphaherpesvirus
1) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C) 		4 THR A 396
LEU A 397
LEU A 385
THR A 400
 None
 0.91A 4z90A-2xqyA:
2.8
4z90B-2xqyA:
2.8
4z90C-2xqyA:
2.8
4z90D-2xqyA:
2.8
4z90E-2xqyA:
2.9		 4z90A-2xqyA:
19.65
4z90B-2xqyA:
19.65
4z90C-2xqyA:
19.65
4z90D-2xqyA:
19.65
4z90E-2xqyA:
19.65
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.
2z2f LYSOZYME C-2

(Bos taurus) 		PF00062
(Lys) 		4 THR A  11
LEU A  12
LEU A   8
THR A  40
 None
 0.92A 4z90A-2z2fA:
undetectable
4z90B-2z2fA:
undetectable
4z90C-2z2fA:
undetectable
4z90D-2z2fA:
undetectable
4z90E-2z2fA:
undetectable		 4z90A-2z2fA:
15.53
4z90B-2z2fA:
15.53
4z90C-2z2fA:
15.53
4z90D-2z2fA:
15.53
4z90E-2z2fA:
15.53
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.
2zuc DNA REPAIR AND
RECOMBINATION
PROTEIN RADA

(Sulfolobus
solfataricus) 		PF08423
(Rad51)
PF14520
(HHH_5) 		4 THR A 152
THR A 149
THR A 254
THR A 121
 None
 0.92A 4z90A-2zucA:
undetectable
4z90B-2zucA:
undetectable
4z90C-2zucA:
undetectable
4z90D-2zucA:
undetectable
4z90E-2zucA:
undetectable		 4z90A-2zucA:
23.46
4z90B-2zucA:
23.46
4z90C-2zucA:
23.46
4z90D-2zucA:
23.46
4z90E-2zucA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3abb CYTOCHROME P450
HYDROXYLASE

(Streptomyces
avermitilis) 		PF00067
(p450) 		4 LEU A 363
LEU A 367
THR A 258
THR A 287
 None
 0.93A 4z90A-3abbA:
undetectable
4z90B-3abbA:
1.5
4z90C-3abbA:
undetectable
4z90D-3abbA:
undetectable
4z90E-3abbA:
undetectable		 4z90A-3abbA:
23.34
4z90B-3abbA:
23.34
4z90C-3abbA:
23.34
4z90D-3abbA:
23.34
4z90E-3abbA:
23.34
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.
3b12 FLUOROACETATE
DEHALOGENASE

(Burkholderia
sp.) 		PF00561
(Abhydrolase_1) 		4 THR A  92
LEU A  93
LEU A  89
THR A  16
 None
 0.87A 4z90A-3b12A:
undetectable
4z90B-3b12A:
undetectable
4z90C-3b12A:
undetectable
4z90D-3b12A:
undetectable
4z90E-3b12A:
undetectable		 4z90A-3b12A:
22.13
4z90B-3b12A:
22.13
4z90C-3b12A:
22.13
4z90D-3b12A:
22.13
4z90E-3b12A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b5n PROTEIN SSO1
PROTEIN TRANSPORT
PROTEIN SEC9
SYNAPTOBREVIN
HOMOLOG 1

(Saccharomyces
cerevisiae) 		PF00804
(Syntaxin)
PF00957
(Synaptobrevin)
PF05739
(SNARE)
no annotation 		4 THR A  29
LEU A  32
LEU B 203
THR C 444
 None
 0.75A 4z90A-3b5nA:
undetectable
4z90B-3b5nA:
undetectable
4z90C-3b5nA:
undetectable
4z90D-3b5nA:
undetectable
4z90E-3b5nA:
undetectable		 4z90A-3b5nA:
10.40
4z90B-3b5nA:
10.40
4z90C-3b5nA:
10.40
4z90D-3b5nA:
10.40
4z90E-3b5nA:
10.40
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.
3cnb DNA-BINDING RESPONSE
REGULATOR, MERR
FAMILY

(Colwellia
psychrerythraea) 		PF00072
(Response_reg) 		4 LEU A 177
LEU A 172
THR A 166
THR A 180
 None
 0.88A 4z90A-3cnbA:
undetectable
4z90B-3cnbA:
undetectable
4z90C-3cnbA:
undetectable
4z90D-3cnbA:
undetectable
4z90E-3cnbA:
undetectable		 4z90A-3cnbA:
17.59
4z90B-3cnbA:
17.59
4z90C-3cnbA:
17.59
4z90D-3cnbA:
17.59
4z90E-3cnbA:
17.59
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.
3cue TRANSPORT PROTEIN
PARTICLE 18 KDA
SUBUNIT
TRANSPORT PROTEIN
PARTICLE 23 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF04099
(Sybindin) 		4 LEU A  36
THR C  55
LEU C  58
THR A  39
 None
 0.92A 4z90A-3cueA:
undetectable
4z90B-3cueA:
undetectable
4z90C-3cueA:
undetectable
4z90D-3cueA:
undetectable
4z90E-3cueA:
undetectable		 4z90A-3cueA:
22.68
4z90B-3cueA:
22.68
4z90C-3cueA:
22.68
4z90D-3cueA:
22.68
4z90E-3cueA:
22.68
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.
3dcf TRANSCRIPTIONAL
REGULATOR OF THE
TETR/ACRR FAMILY

(Thermobifida
fusca) 		PF00440
(TetR_N) 		4 THR A 206
LEU A 209
LEU A 111
THR A 186
 None
 0.93A 4z90A-3dcfA:
3.4
4z90B-3dcfA:
3.4
4z90C-3dcfA:
3.1
4z90D-3dcfA:
3.5
4z90E-3dcfA:
3.4		 4z90A-3dcfA:
23.31
4z90B-3dcfA:
23.31
4z90C-3dcfA:
23.31
4z90D-3dcfA:
23.31
4z90E-3dcfA:
23.31
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.
3fhx PYRIDOXAL KINASE

(Homo sapiens) 		PF08543
(Phos_pyr_kin) 		4 THR A 233
LEU A 236
LEU A 263
THR A 270
 ATP  A 407 (-3.4A)
None
ATP  A 407 ( 4.1A)
None
 0.91A 4z90A-3fhxA:
2.4
4z90B-3fhxA:
2.4
4z90C-3fhxA:
undetectable
4z90D-3fhxA:
2.3
4z90E-3fhxA:
undetectable		 4z90A-3fhxA:
22.01
4z90B-3fhxA:
22.01
4z90C-3fhxA:
22.01
4z90D-3fhxA:
22.01
4z90E-3fhxA:
22.01
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.
3gdw SIGMA-54 INTERACTION
DOMAIN PROTEIN

(Enterococcus
faecalis) 		PF03610
(EIIA-man) 		4 THR A 563
LEU A 567
THR A 638
LEU A 642
 None
 0.88A 4z90A-3gdwA:
undetectable
4z90B-3gdwA:
undetectable
4z90C-3gdwA:
undetectable
4z90D-3gdwA:
undetectable
4z90E-3gdwA:
undetectable		 4z90A-3gdwA:
21.72
4z90B-3gdwA:
21.72
4z90C-3gdwA:
21.72
4z90D-3gdwA:
21.72
4z90E-3gdwA:
21.72
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.
3h39 TRNA NUCLEOTIDYL
TRANSFERASE-RELATED
PROTEIN

(Thermotoga
maritima) 		PF01743
(PolyA_pol)
PF12627
(PolyA_pol_RNAbd) 		4 LEU A 179
LEU A 221
THR A 212
THR A 176
 None
None
None
ATP  A 501 (-4.6A)
 0.88A 4z90A-3h39A:
undetectable
4z90B-3h39A:
undetectable
4z90C-3h39A:
undetectable
4z90D-3h39A:
undetectable
4z90E-3h39A:
undetectable		 4z90A-3h39A:
21.90
4z90B-3h39A:
21.90
4z90C-3h39A:
21.90
4z90D-3h39A:
21.90
4z90E-3h39A:
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.
3hpg INTEGRASE

(Visna-maedi
virus) 		PF00665
(rve)
PF02022
(Integrase_Zn) 		4 THR A 159
LEU A 160
THR A 184
THR A 163
 None
 0.93A 4z90A-3hpgA:
undetectable
4z90B-3hpgA:
undetectable
4z90C-3hpgA:
undetectable
4z90D-3hpgA:
undetectable
4z90E-3hpgA:
undetectable		 4z90A-3hpgA:
18.58
4z90B-3hpgA:
18.58
4z90C-3hpgA:
18.58
4z90D-3hpgA:
18.58
4z90E-3hpgA:
18.58
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.
3i7m XAA-PRO DIPEPTIDASE

(Lactobacillus
brevis) 		PF01321
(Creatinase_N) 		4 THR A  26
LEU A  30
LEU A  44
THR A  19
 None
 0.79A 4z90A-3i7mA:
undetectable
4z90B-3i7mA:
undetectable
4z90C-3i7mA:
undetectable
4z90D-3i7mA:
undetectable
4z90E-3i7mA:
undetectable		 4z90A-3i7mA:
18.15
4z90B-3i7mA:
18.15
4z90C-3i7mA:
18.15
4z90D-3i7mA:
18.15
4z90E-3i7mA:
18.15
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.
3k70 EXODEOXYRIBONUCLEASE
V ALPHA CHAIN

(Escherichia
coli) 		PF13538
(UvrD_C_2)
PF13604
(AAA_30) 		4 THR D 163
LEU D 162
LEU D 137
THR D 333
 None
 0.65A 4z90A-3k70D:
undetectable
4z90B-3k70D:
undetectable
4z90C-3k70D:
undetectable
4z90D-3k70D:
undetectable
4z90E-3k70D:
undetectable		 4z90A-3k70D:
19.66
4z90B-3k70D:
19.66
4z90C-3k70D:
19.66
4z90D-3k70D:
19.66
4z90E-3k70D:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k8p DSL1

(Kluyveromyces
lactis) 		PF11989
(Dsl1_C) 		4 LEU C 511
LEU C 507
THR C 480
THR C 556
 None
 0.70A 4z90A-3k8pC:
4.3
4z90B-3k8pC:
3.1
4z90C-3k8pC:
4.5
4z90D-3k8pC:
4.4
4z90E-3k8pC:
4.4		 4z90A-3k8pC:
21.22
4z90B-3k8pC:
21.22
4z90C-3k8pC:
21.22
4z90D-3k8pC:
21.22
4z90E-3k8pC:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kxp ALPHA-(N-ACETYLAMINO
METHYLENE)SUCCINIC
ACID HYDROLASE

(Mesorhizobium
loti) 		PF12697
(Abhydrolase_6) 		4 THR A  94
LEU A  95
LEU A  91
THR A  23
 None
 0.93A 4z90A-3kxpA:
undetectable
4z90B-3kxpA:
undetectable
4z90C-3kxpA:
undetectable
4z90D-3kxpA:
undetectable
4z90E-3kxpA:
undetectable		 4z90A-3kxpA:
21.61
4z90B-3kxpA:
21.61
4z90C-3kxpA:
21.61
4z90D-3kxpA:
21.61
4z90E-3kxpA:
21.61
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.
3ly9 TRANSCRIPTIONAL
ACTIVATOR CADC

(Escherichia
coli) 		no annotation 5 LEU A 226
THR A 325
LEU A 326
THR A 233
THR A 229
 None
 1.19A 4z90A-3ly9A:
2.8
4z90B-3ly9A:
undetectable
4z90C-3ly9A:
2.2
4z90D-3ly9A:
undetectable
4z90E-3ly9A:
undetectable		 4z90A-3ly9A:
21.13
4z90B-3ly9A:
21.13
4z90C-3ly9A:
21.13
4z90D-3ly9A:
21.13
4z90E-3ly9A:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ly9 TRANSCRIPTIONAL
ACTIVATOR CADC

(Escherichia
coli) 		no annotation 4 THR A 325
LEU A 326
THR A 233
THR A 229
 None
 0.91A 4z90A-3ly9A:
2.8
4z90B-3ly9A:
undetectable
4z90C-3ly9A:
2.2
4z90D-3ly9A:
undetectable
4z90E-3ly9A:
undetectable		 4z90A-3ly9A:
21.13
4z90B-3ly9A:
21.13
4z90C-3ly9A:
21.13
4z90D-3ly9A:
21.13
4z90E-3ly9A:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mde MEDIUM CHAIN
ACYL-COA
DEHYDROGENASE

(Sus scrofa) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 THR A  84
LEU A  87
THR A 102
THR A  64
 None
 0.77A 4z90A-3mdeA:
3.1
4z90B-3mdeA:
3.4
4z90C-3mdeA:
3.0
4z90D-3mdeA:
2.9
4z90E-3mdeA:
3.0		 4z90A-3mdeA:
21.09
4z90B-3mdeA:
21.09
4z90C-3mdeA:
21.09
4z90D-3mdeA:
21.09
4z90E-3mdeA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mde MEDIUM CHAIN
ACYL-COA
DEHYDROGENASE

(Sus scrofa) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 THR A  84
LEU A  87
THR A 102
THR A  64
 None
 0.87A 4z90A-3mdeA:
3.1
4z90B-3mdeA:
3.4
4z90C-3mdeA:
3.0
4z90D-3mdeA:
2.9
4z90E-3mdeA:
3.0		 4z90A-3mdeA:
21.09
4z90B-3mdeA:
21.09
4z90C-3mdeA:
21.09
4z90D-3mdeA:
21.09
4z90E-3mdeA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3myr HYDROGENASE (NIFE)
SMALL SUBUNIT HYDA
NICKEL-DEPENDENT
HYDROGENASE LARGE
SUBUNIT

(Allochromatium
vinosum) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 THR A  24
LEU A  31
LEU B1195
THR A  46
 None
 0.92A 4z90A-3myrA:
undetectable
4z90B-3myrA:
undetectable
4z90C-3myrA:
undetectable
4z90D-3myrA:
undetectable
4z90E-3myrA:
undetectable		 4z90A-3myrA:
20.23
4z90B-3myrA:
20.23
4z90C-3myrA:
20.23
4z90D-3myrA:
20.23
4z90E-3myrA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n1u HYDROLASE, HAD
SUPERFAMILY,
SUBFAMILY III A

(Legionella
pneumophila) 		PF08282
(Hydrolase_3) 		4 THR A 105
LEU A 106
LEU A 102
THR A  86
 None
 0.91A 4z90A-3n1uA:
undetectable
4z90B-3n1uA:
undetectable
4z90C-3n1uA:
undetectable
4z90D-3n1uA:
undetectable
4z90E-3n1uA:
undetectable		 4z90A-3n1uA:
18.46
4z90B-3n1uA:
18.46
4z90C-3n1uA:
18.46
4z90D-3n1uA:
18.46
4z90E-3n1uA:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n2x UNCHARACTERIZED
PROTEIN YAGE

(Escherichia
coli) 		PF00701
(DHDPS) 		4 THR A 210
LEU A 211
LEU A 207
THR A  15
 None
 0.92A 4z90A-3n2xA:
undetectable
4z90B-3n2xA:
undetectable
4z90C-3n2xA:
undetectable
4z90D-3n2xA:
undetectable
4z90E-3n2xA:
undetectable		 4z90A-3n2xA:
22.19
4z90B-3n2xA:
22.19
4z90C-3n2xA:
22.19
4z90D-3n2xA:
22.19
4z90E-3n2xA:
22.19
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.
3omb EXTRACELLULAR
SOLUTE-BINDING
PROTEIN, FAMILY 1

(Bifidobacterium
longum) 		PF01547
(SBP_bac_1) 		4 THR A 259
LEU A 258
LEU A 513
THR A 522
 None
 0.88A 4z90A-3ombA:
2.5
4z90B-3ombA:
undetectable
4z90C-3ombA:
undetectable
4z90D-3ombA:
undetectable
4z90E-3ombA:
undetectable		 4z90A-3ombA:
21.05
4z90B-3ombA:
21.05
4z90C-3ombA:
21.05
4z90D-3ombA:
21.05
4z90E-3ombA:
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.
3onm TRANSCRIPTIONAL
REGULATOR LRHA

(Yersinia
pseudotuberculosis) 		PF03466
(LysR_substrate) 		4 THR A 109
LEU A 113
THR A 154
THR A 262
 None
 0.82A 4z90A-3onmA:
undetectable
4z90B-3onmA:
undetectable
4z90C-3onmA:
undetectable
4z90D-3onmA:
undetectable
4z90E-3onmA:
undetectable		 4z90A-3onmA:
18.73
4z90B-3onmA:
18.73
4z90C-3onmA:
18.73
4z90D-3onmA:
18.73
4z90E-3onmA:
18.73
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.
3onm TRANSCRIPTIONAL
REGULATOR LRHA

(Yersinia
pseudotuberculosis) 		PF03466
(LysR_substrate) 		4 THR A 109
LEU A 113
THR A 154
THR A 262
 None
 0.83A 4z90A-3onmA:
undetectable
4z90B-3onmA:
undetectable
4z90C-3onmA:
undetectable
4z90D-3onmA:
undetectable
4z90E-3onmA:
undetectable		 4z90A-3onmA:
18.73
4z90B-3onmA:
18.73
4z90C-3onmA:
18.73
4z90D-3onmA:
18.73
4z90E-3onmA:
18.73
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.
3opb SWI5-DEPENDENT HO
EXPRESSION PROTEIN 4

(Saccharomyces
cerevisiae) 		PF11701
(UNC45-central) 		4 LEU A 578
THR A 621
LEU A 624
THR A 605
 None
 0.77A 4z90A-3opbA:
undetectable
4z90B-3opbA:
undetectable
4z90C-3opbA:
undetectable
4z90D-3opbA:
undetectable
4z90E-3opbA:
undetectable		 4z90A-3opbA:
17.39
4z90B-3opbA:
17.39
4z90C-3opbA:
17.39
4z90D-3opbA:
17.39
4z90E-3opbA:
17.39
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.
3ouk PROBABLE CONSERVED
TRANSMEMBRANE
PROTEIN

(Mycobacterium
tuberculosis) 		no annotation 4 THR A  74
LEU A  75
LEU A  71
THR A  58
 None
 0.70A 4z90A-3oukA:
2.1
4z90B-3oukA:
2.0
4z90C-3oukA:
undetectable
4z90D-3oukA:
undetectable
4z90E-3oukA:
undetectable		 4z90A-3oukA:
20.90
4z90B-3oukA:
20.90
4z90C-3oukA:
20.90
4z90D-3oukA:
20.90
4z90E-3oukA:
20.90
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.
3pf0 IMELYSIN-LIKE
PROTEIN

(Psychrobacter
arcticus) 		PF09375
(Peptidase_M75) 		5 LEU A 373
THR A 328
LEU A 329
THR A 324
THR A 376
 None
 1.49A 4z90A-3pf0A:
2.0
4z90B-3pf0A:
1.7
4z90C-3pf0A:
undetectable
4z90D-3pf0A:
undetectable
4z90E-3pf0A:
undetectable		 4z90A-3pf0A:
20.21
4z90B-3pf0A:
20.21
4z90C-3pf0A:
20.21
4z90D-3pf0A:
20.21
4z90E-3pf0A:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3re9 SORTASE-LIKE PROTEIN

(Streptococcus
suis) 		PF04203
(Sortase) 		5 LEU A 206
THR A 156
LEU A 218
THR A 127
THR A 142
 None
 1.39A 4z90A-3re9A:
undetectable
4z90B-3re9A:
undetectable
4z90C-3re9A:
undetectable
4z90D-3re9A:
undetectable
4z90E-3re9A:
undetectable		 4z90A-3re9A:
19.51
4z90B-3re9A:
19.51
4z90C-3re9A:
19.51
4z90D-3re9A:
19.51
4z90E-3re9A:
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.
3smv S-(-)-AZETIDINE-2-CA
RBOXYLATE HYDROLASE

(Pseudomonas sp.
AC2) 		PF13419
(HAD_2) 		5 THR A 104
LEU A 108
THR A  16
LEU A  17
THR A 178
 None
 1.44A 4z90A-3smvA:
undetectable
4z90B-3smvA:
undetectable
4z90C-3smvA:
undetectable
4z90D-3smvA:
undetectable
4z90E-3smvA:
undetectable		 4z90A-3smvA:
22.67
4z90B-3smvA:
22.67
4z90C-3smvA:
22.67
4z90D-3smvA:
22.67
4z90E-3smvA:
22.67
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.
3tb5 METHIONINE
AMINOPEPTIDASE

(Enterococcus
faecalis) 		PF00557
(Peptidase_M24) 		4 LEU A 122
LEU A  90
THR A 222
THR A 206
 None
 0.88A 4z90A-3tb5A:
undetectable
4z90B-3tb5A:
undetectable
4z90C-3tb5A:
undetectable
4z90D-3tb5A:
undetectable
4z90E-3tb5A:
undetectable		 4z90A-3tb5A:
20.24
4z90B-3tb5A:
20.24
4z90C-3tb5A:
20.24
4z90D-3tb5A:
20.24
4z90E-3tb5A:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vas PUTATIVE ADENOSINE
KINASE

(Schistosoma
mansoni) 		PF00294
(PfkB) 		4 LEU A 138
LEU A  16
THR A  66
THR A 173
 ADN  A 401 (-4.9A)
ADN  A 401 (-4.7A)
CL  A 402 (-3.8A)
None
 0.79A 4z90A-3vasA:
undetectable
4z90B-3vasA:
undetectable
4z90C-3vasA:
undetectable
4z90D-3vasA:
undetectable
4z90E-3vasA:
undetectable		 4z90A-3vasA:
21.19
4z90B-3vasA:
21.19
4z90C-3vasA:
21.19
4z90D-3vasA:
21.19
4z90E-3vasA:
21.19
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.
3wnb PROTEIN TRANSLATION
ELONGATION FACTOR 1A

(Methanosarcina
mazei) 		no annotation 4 LEU A 113
THR A 100
LEU A  99
THR A  80
 None
 0.92A 4z90A-3wnbA:
undetectable
4z90B-3wnbA:
undetectable
4z90C-3wnbA:
undetectable
4z90D-3wnbA:
undetectable
4z90E-3wnbA:
undetectable		 4z90A-3wnbA:
19.18
4z90B-3wnbA:
19.18
4z90C-3wnbA:
19.18
4z90D-3wnbA:
19.18
4z90E-3wnbA:
19.18
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.
3wo6 MEMBRANE PROTEIN
INSERTASE YIDC 2

(Bacillus
halodurans) 		PF02096
(60KD_IMP) 		4 THR A  79
LEU A  80
LEU A  76
THR A 255
 None
 0.90A 4z90A-3wo6A:
2.1
4z90B-3wo6A:
2.7
4z90C-3wo6A:
2.7
4z90D-3wo6A:
2.7
4z90E-3wo6A:
2.8		 4z90A-3wo6A:
19.31
4z90B-3wo6A:
19.31
4z90C-3wo6A:
19.31
4z90D-3wo6A:
19.31
4z90E-3wo6A:
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.
3zh7 PROTEIN E

(Haemophilus
influenzae) 		PF16747
(Adhesin_E) 		4 THR A 138
LEU A 140
THR A 135
LEU A 134
 None
EDO  A1154 ( 4.0A)
None
None
 0.75A 4z90A-3zh7A:
undetectable
4z90B-3zh7A:
undetectable
4z90C-3zh7A:
undetectable
4z90D-3zh7A:
undetectable
4z90E-3zh7A:
undetectable		 4z90A-3zh7A:
21.90
4z90B-3zh7A:
21.90
4z90C-3zh7A:
21.90
4z90D-3zh7A:
21.90
4z90E-3zh7A:
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.
4a5g ANIONIC PEROXIDASE

(Raphanus
sativus) 		PF00141
(peroxidase) 		4 THR A 161
LEU A 164
THR A 254
THR A 151
 None
 0.82A 4z90A-4a5gA:
undetectable
4z90B-4a5gA:
undetectable
4z90C-4a5gA:
undetectable
4z90D-4a5gA:
undetectable
4z90E-4a5gA:
undetectable		 4z90A-4a5gA:
19.53
4z90B-4a5gA:
19.53
4z90C-4a5gA:
19.53
4z90D-4a5gA:
19.53
4z90E-4a5gA:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a7l MYOSIN IE HEAVY
CHAIN

(Dictyostelium
discoideum) 		PF00063
(Myosin_head) 		4 THR C 576
LEU C 577
LEU C 573
THR C 180
 None
 0.91A 4z90A-4a7lC:
undetectable
4z90B-4a7lC:
undetectable
4z90C-4a7lC:
undetectable
4z90D-4a7lC:
undetectable
4z90E-4a7lC:
undetectable		 4z90A-4a7lC:
19.39
4z90B-4a7lC:
19.39
4z90C-4a7lC:
19.39
4z90D-4a7lC:
19.39
4z90E-4a7lC:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aii GTP-BINDING PROTEIN
REM 2

(Rattus
norvegicus) 		PF00071
(Ras) 		5 THR A 259
THR A 267
LEU A 270
THR A 134
THR A 130
 None
None
None
None
GDP  A1284 (-3.4A)
 1.18A 4z90A-4aiiA:
undetectable
4z90B-4aiiA:
undetectable
4z90C-4aiiA:
undetectable
4z90D-4aiiA:
undetectable
4z90E-4aiiA:
undetectable		 4z90A-4aiiA:
18.27
4z90B-4aiiA:
18.27
4z90C-4aiiA:
18.27
4z90D-4aiiA:
18.27
4z90E-4aiiA:
18.27
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.
4cuo BANYAN PEROXIDASE

(Ficus
benghalensis) 		PF00141
(peroxidase) 		4 LEU A 148
THR A 159
LEU A 162
THR A 252
 None
NAG  A1325 (-3.0A)
None
None
 0.91A 4z90A-4cuoA:
undetectable
4z90B-4cuoA:
undetectable
4z90C-4cuoA:
undetectable
4z90D-4cuoA:
undetectable
4z90E-4cuoA:
undetectable		 4z90A-4cuoA:
22.03
4z90B-4cuoA:
22.03
4z90C-4cuoA:
22.03
4z90D-4cuoA:
22.03
4z90E-4cuoA:
22.03
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.
4db1 MYOSIN-7

(Homo sapiens) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		4 THR A 619
LEU A 620
LEU A 616
THR A 441
 None
 0.68A 4z90A-4db1A:
2.8
4z90B-4db1A:
undetectable
4z90C-4db1A:
undetectable
4z90D-4db1A:
undetectable
4z90E-4db1A:
undetectable		 4z90A-4db1A:
17.34
4z90B-4db1A:
17.34
4z90C-4db1A:
17.34
4z90D-4db1A:
17.34
4z90E-4db1A:
17.34
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.
4ddw REVERSE GYRASE

(Thermotoga
maritima) 		PF00270
(DEAD)
PF01131
(Topoisom_bac)
PF01751
(Toprim) 		4 LEU A 653
THR A 681
LEU A 684
THR A 588
 None
 0.87A 4z90A-4ddwA:
undetectable
4z90B-4ddwA:
undetectable
4z90C-4ddwA:
undetectable
4z90D-4ddwA:
undetectable
4z90E-4ddwA:
undetectable		 4z90A-4ddwA:
15.62
4z90B-4ddwA:
15.62
4z90C-4ddwA:
15.62
4z90D-4ddwA:
15.62
4z90E-4ddwA:
15.62
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.
4e1j GLYCEROL KINASE

(Sinorhizobium
meliloti) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 LEU A 213
LEU A 236
THR A 189
THR A 186
THR A 211
 None
 1.32A 4z90A-4e1jA:
undetectable
4z90B-4e1jA:
undetectable
4z90C-4e1jA:
undetectable
4z90D-4e1jA:
undetectable
4z90E-4e1jA:
undetectable		 4z90A-4e1jA:
19.58
4z90B-4e1jA:
19.58
4z90C-4e1jA:
19.58
4z90D-4e1jA:
19.58
4z90E-4e1jA:
19.58
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.
4ecn LEUCINE-RICH REPEAT
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF14660
(DUF4458) 		4 THR A 755
LEU A 758
THR A 779
LEU A 780
 None
 0.84A 4z90A-4ecnA:
undetectable
4z90B-4ecnA:
undetectable
4z90C-4ecnA:
undetectable
4z90D-4ecnA:
undetectable
4z90E-4ecnA:
undetectable		 4z90A-4ecnA:
17.43
4z90B-4ecnA:
17.43
4z90C-4ecnA:
17.43
4z90D-4ecnA:
17.43
4z90E-4ecnA:
17.43
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.
4eco UNCHARACTERIZED
PROTEIN

(Bacteroides
eggerthii) 		no annotation 4 THR A 755
LEU A 758
THR A 779
LEU A 780
 None
 0.79A 4z90A-4ecoA:
undetectable
4z90B-4ecoA:
undetectable
4z90C-4ecoA:
undetectable
4z90D-4ecoA:
undetectable
4z90E-4ecoA:
undetectable		 4z90A-4ecoA:
20.31
4z90B-4ecoA:
20.31
4z90C-4ecoA:
20.31
4z90D-4ecoA:
20.31
4z90E-4ecoA:
20.31
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.
4ees PHOTOTROPIN-2

(Arabidopsis
thaliana) 		PF13426
(PAS_9) 		4 LEU A 470
THR A 452
LEU A 472
THR A 438
 FMN  A1001 (-4.2A)
None
FMN  A1001 (-4.8A)
None
 0.93A 4z90A-4eesA:
undetectable
4z90B-4eesA:
undetectable
4z90C-4eesA:
undetectable
4z90D-4eesA:
undetectable
4z90E-4eesA:
undetectable		 4z90A-4eesA:
18.30
4z90B-4eesA:
18.30
4z90C-4eesA:
18.30
4z90D-4eesA:
18.30
4z90E-4eesA:
18.30
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.
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis) 		no annotation 4 THR A 157
LEU A 158
LEU A 143
THR A   8
 None
EDO  A 317 (-4.0A)
None
EDO  A 321 ( 3.2A)
 0.79A 4z90A-4ehcA:
undetectable
4z90B-4ehcA:
undetectable
4z90C-4ehcA:
undetectable
4z90D-4ehcA:
undetectable
4z90E-4ehcA:
undetectable		 4z90A-4ehcA:
21.94
4z90B-4ehcA:
21.94
4z90C-4ehcA:
21.94
4z90D-4ehcA:
21.94
4z90E-4ehcA:
21.94
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.
4eht ACTIVATOR OF
2-HYDROXYISOCAPROYL-
COA DEHYDRATASE

(Clostridioides
difficile) 		PF01869
(BcrAD_BadFG) 		4 LEU A 108
THR A  94
LEU A 110
THR A 243
 None
 0.91A 4z90A-4ehtA:
2.0
4z90B-4ehtA:
2.0
4z90C-4ehtA:
undetectable
4z90D-4ehtA:
undetectable
4z90E-4ehtA:
undetectable		 4z90A-4ehtA:
21.25
4z90B-4ehtA:
21.25
4z90C-4ehtA:
21.25
4z90D-4ehtA:
21.25
4z90E-4ehtA:
21.25
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.
4evq PUTATIVE ABC
TRANSPORTER SUBUNIT,
SUBSTRATE-BINDING
COMPONENT

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		4 THR A  91
LEU A  94
LEU A 103
THR A 106
 None
 0.93A 4z90A-4evqA:
undetectable
4z90B-4evqA:
undetectable
4z90C-4evqA:
undetectable
4z90D-4evqA:
undetectable
4z90E-4evqA:
undetectable		 4z90A-4evqA:
20.21
4z90B-4evqA:
20.21
4z90C-4evqA:
20.21
4z90D-4evqA:
20.21
4z90E-4evqA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fgm AMINOPEPTIDASE N
FAMILY PROTEIN

(Idiomarina
loihiensis) 		PF05299
(Peptidase_M61)
PF13180
(PDZ_2) 		4 LEU A 214
THR A 320
LEU A 317
THR A 400
 None
 0.90A 4z90A-4fgmA:
4.9
4z90B-4fgmA:
undetectable
4z90C-4fgmA:
4.8
4z90D-4fgmA:
4.7
4z90E-4fgmA:
undetectable		 4z90A-4fgmA:
20.84
4z90B-4fgmA:
20.84
4z90C-4fgmA:
20.84
4z90D-4fgmA:
20.84
4z90E-4fgmA:
20.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h40 PUTATIVE CELL
ADHESION PROTEIN

(Bacteroides
fragilis) 		PF15415
(Mfa_like_2) 		4 LEU A 294
LEU A 218
THR A 331
THR A 301
 None
 0.93A 4z90A-4h40A:
undetectable
4z90B-4h40A:
undetectable
4z90C-4h40A:
undetectable
4z90D-4h40A:
undetectable
4z90E-4h40A:
undetectable		 4z90A-4h40A:
22.55
4z90B-4h40A:
22.55
4z90C-4h40A:
22.55
4z90D-4h40A:
22.55
4z90E-4h40A:
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.
4hyy MEIOTIC
RECOMBINATION
PROTEIN DMC1/LIM15
HOMOLOG

(Homo sapiens) 		PF08423
(Rad51) 		4 THR A 138
LEU A 139
LEU A 135
THR A 142
 None
 0.91A 4z90A-4hyyA:
undetectable
4z90B-4hyyA:
undetectable
4z90C-4hyyA:
undetectable
4z90D-4hyyA:
undetectable
4z90E-4hyyA:
undetectable		 4z90A-4hyyA:
18.83
4z90B-4hyyA:
18.83
4z90C-4hyyA:
18.83
4z90D-4hyyA:
18.83
4z90E-4hyyA:
18.83
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.
4ihq FLAI ATPASE

(Sulfolobus
acidocaldarius) 		PF00437
(T2SSE) 		4 THR A 269
LEU A 272
LEU A 294
THR A 358
 MG  A 602 ( 3.0A)
None
None
MG  A 602 ( 4.8A)
 0.64A 4z90A-4ihqA:
undetectable
4z90B-4ihqA:
undetectable
4z90C-4ihqA:
undetectable
4z90D-4ihqA:
undetectable
4z90E-4ihqA:
undetectable		 4z90A-4ihqA:
21.41
4z90B-4ihqA:
21.41
4z90C-4ihqA:
21.41
4z90D-4ihqA:
21.41
4z90E-4ihqA:
21.41
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.
4jlv C-TERMINAL FRAGMENT
OF MEMBRANE PROTEIN
CAPA1, PUTATIVE
UNCHARACTERIZED
PROTEIN CAPB1

(Staphylococcus
aureus) 		PF13614
(AAA_31) 		5 LEU A1100
THR A1123
LEU A1122
THR A1112
THR A1105
 None
 1.22A 4z90A-4jlvA:
undetectable
4z90B-4jlvA:
undetectable
4z90C-4jlvA:
undetectable
4z90D-4jlvA:
undetectable
4z90E-4jlvA:
undetectable		 4z90A-4jlvA:
22.56
4z90B-4jlvA:
22.56
4z90C-4jlvA:
22.56
4z90D-4jlvA:
22.56
4z90E-4jlvA:
22.56
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.
4k6j WINGS APART-LIKE
PROTEIN HOMOLOG

(Homo sapiens) 		PF07814
(WAPL) 		4 LEU A 681
THR A 720
LEU A 723
THR A 706
 None
 0.77A 4z90A-4k6jA:
3.2
4z90B-4k6jA:
3.4
4z90C-4k6jA:
3.4
4z90D-4k6jA:
3.4
4z90E-4k6jA:
3.2		 4z90A-4k6jA:
20.21
4z90B-4k6jA:
20.21
4z90C-4k6jA:
20.21
4z90D-4k6jA:
20.21
4z90E-4k6jA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4km3 METHIONINE
AMINOPEPTIDASE

(Streptococcus
pneumoniae) 		PF00557
(Peptidase_M24) 		4 LEU A 153
LEU A  94
THR A 254
THR A 237
 None
 0.79A 4z90A-4km3A:
undetectable
4z90B-4km3A:
undetectable
4z90C-4km3A:
undetectable
4z90D-4km3A:
undetectable
4z90E-4km3A:
undetectable		 4z90A-4km3A:
20.60
4z90B-4km3A:
20.60
4z90C-4km3A:
20.60
4z90D-4km3A:
20.60
4z90E-4km3A:
20.60
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.
4kt7 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Anaerococcus
prevotii) 		PF01128
(IspD) 		4 THR A  40
LEU A  41
LEU A  37
THR A  12
 None
 0.92A 4z90A-4kt7A:
undetectable
4z90B-4kt7A:
undetectable
4z90C-4kt7A:
undetectable
4z90D-4kt7A:
undetectable
4z90E-4kt7A:
undetectable		 4z90A-4kt7A:
21.41
4z90B-4kt7A:
21.41
4z90C-4kt7A:
21.41
4z90D-4kt7A:
21.41
4z90E-4kt7A:
21.41
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.
4lfy DIHYDROOROTASE

(Burkholderia
cenocepacia) 		PF01979
(Amidohydro_1) 		4 LEU A 151
THR A 140
LEU A 141
THR A  99
 None
 0.80A 4z90A-4lfyA:
undetectable
4z90B-4lfyA:
undetectable
4z90C-4lfyA:
undetectable
4z90D-4lfyA:
undetectable
4z90E-4lfyA:
undetectable		 4z90A-4lfyA:
23.82
4z90B-4lfyA:
23.82
4z90C-4lfyA:
23.82
4z90D-4lfyA:
23.82
4z90E-4lfyA:
23.82
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.
4lgl GLYCINE
DEHYDROGENASE
[DECARBOXYLATING]

(Synechocystis
sp. PCC 6803) 		PF02347
(GDC-P) 		4 LEU A 456
THR A 386
LEU A 389
THR A 408
 None
 0.90A 4z90A-4lglA:
undetectable
4z90B-4lglA:
undetectable
4z90C-4lglA:
undetectable
4z90D-4lglA:
undetectable
4z90E-4lglA:
undetectable		 4z90A-4lglA:
17.65
4z90B-4lglA:
17.65
4z90C-4lglA:
17.65
4z90D-4lglA:
17.65
4z90E-4lglA:
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.
4mjk CRISPR PROTEIN

(Archaeoglobus
fulgidus) 		PF09704
(Cas_Cas5d) 		4 THR A  24
LEU A  21
LEU A 202
THR A  35
 None
 0.88A 4z90A-4mjkA:
undetectable
4z90B-4mjkA:
undetectable
4z90C-4mjkA:
undetectable
4z90D-4mjkA:
undetectable
4z90E-4mjkA:
undetectable		 4z90A-4mjkA:
21.73
4z90B-4mjkA:
21.73
4z90C-4mjkA:
21.73
4z90D-4mjkA:
21.73
4z90E-4mjkA:
21.73
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.
4mnr PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE

(Eggerthella
lenta) 		PF00905
(Transpeptidase) 		4 LEU A 277
THR A 317
LEU A 177
THR A 273
 None
 0.87A 4z90A-4mnrA:
undetectable
4z90B-4mnrA:
undetectable
4z90C-4mnrA:
undetectable
4z90D-4mnrA:
undetectable
4z90E-4mnrA:
undetectable		 4z90A-4mnrA:
20.39
4z90B-4mnrA:
20.39
4z90C-4mnrA:
20.39
4z90D-4mnrA:
20.39
4z90E-4mnrA:
20.39