SIMILAR PATTERNS OF AMINO ACIDS FOR 3DMT_C_CCSC166

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.
1bbu PROTEIN (LYSYL-TRNA
SYNTHETASE)


(Escherichia
coli)
PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
4 SER A 488
THR A 486
ASN A 487
TYR A 312
None
0.94A 3dmtC-1bbuA:
undetectable
3dmtC-1bbuA:
21.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1dbv GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Geobacillus
stearothermophilus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN O 313
TYR O 317
ASN O 152
TYR O 311
NAD  O 336 (-4.2A)
NAD  O 336 (-3.7A)
None
None
0.94A 3dmtC-1dbvO:
48.5
3dmtC-1dbvO:
51.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1dbv GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Geobacillus
stearothermophilus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER O 148
THR O 150
ASN O 152
CYH O 153
HIS O 176
TYR O 311
ASN O 313
TYR O 317
SO4  O 339 (-2.9A)
SO4  O 339 ( 4.5A)
None
None
None
None
NAD  O 336 (-4.2A)
NAD  O 336 (-3.7A)
0.31A 3dmtC-1dbvO:
48.5
3dmtC-1dbvO:
51.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e1t LYSYL-TRNA
SYNTHETASE, HEAT
INDUCIBLE


(Escherichia
coli)
PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
4 SER A 488
THR A 486
ASN A 487
TYR A 312
None
None
None
GOL  A 605 (-4.4A)
0.87A 3dmtC-1e1tA:
undetectable
3dmtC-1e1tA:
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.
1ezf FARNESYL-DIPHOSPHATE
FARNESYLTRANSFERASE


(Homo sapiens)
PF00494
(SQS_PSY)
4 SER A 355
ASN A 260
CYH A 258
ASN A 265
None
1.01A 3dmtC-1ezfA:
undetectable
3dmtC-1ezfA:
20.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gae D-GLYCERALDEHYDE-3-P
HOSPHATE
DEHYDROGENASE


(Escherichia
coli)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER O 148
THR O 150
ASN O 152
CYH O 153
HIS O 176
TYR O 311
TYR O 317
None
None
None
None
None
None
NAD  O 336 ( 3.9A)
0.30A 3dmtC-1gaeO:
46.6
3dmtC-1gaeO:
51.40
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.
1gw1 MANNAN
ENDO-1,4-BETA-MANNOS
IDASE


(Cellvibrio
japonicus)
PF02156
(Glyco_hydro_26)
5 SER A  95
THR A  97
ASN A  99
HIS A  77
ASN A 362
None
1.02A 3dmtC-1gw1A:
undetectable
3dmtC-1gw1A:
21.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gyq PROTEIN
(GLYCERALDEHYDE-3-PH
OSPHATE
DEHYDROGENASE)


(Leishmania
mexicana)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 335
TYR A 339
ASN A 169
TYR A 333
NBD  A 361 (-3.9A)
NBD  A 361 (-3.6A)
None
None
0.91A 3dmtC-1gyqA:
55.9
3dmtC-1gyqA:
84.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gyq PROTEIN
(GLYCERALDEHYDE-3-PH
OSPHATE
DEHYDROGENASE)


(Leishmania
mexicana)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 165
THR A 167
ASN A 169
CYH A 170
HIS A 194
TYR A 333
ASN A 335
TYR A 339
None
None
None
None
None
None
NBD  A 361 (-3.9A)
NBD  A 361 (-3.6A)
0.27A 3dmtC-1gyqA:
55.9
3dmtC-1gyqA:
84.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hdg HOLO-D-GLYCERALDEHYD
E-3-PHOSPHATE
DEHYDROGENASE


(Thermotoga
maritima)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN O 313
TYR O 317
ASN O 152
TYR O 311
NAD  O 336 (-3.9A)
NAD  O 336 (-3.5A)
None
None
0.99A 3dmtC-1hdgO:
46.9
3dmtC-1hdgO:
47.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hdg HOLO-D-GLYCERALDEHYD
E-3-PHOSPHATE
DEHYDROGENASE


(Thermotoga
maritima)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER O 148
THR O 150
ASN O 152
HIS O 176
TYR O 311
ASN O 313
TYR O 317
SO4  O 339 (-2.8A)
SO4  O 339 (-3.5A)
None
SO4  O 339 (-4.4A)
None
NAD  O 336 (-3.9A)
NAD  O 336 (-3.5A)
0.33A 3dmtC-1hdgO:
46.9
3dmtC-1hdgO:
47.88
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.
1igy IGG1 INTACT ANTIBODY
MAB61.1.3


(Mus musculus)
PF07654
(C1-set)
PF07686
(V-set)
4 THR B  57
ASN B  58
TYR B  59
TYR B  50
None
1.02A 3dmtC-1igyB:
undetectable
3dmtC-1igyB:
20.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jn0 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
A


(Spinacia
oleracea)
no annotation 4 ASN O 313
TYR O 317
ASN O 152
TYR O 311
NDP  O6335 (-3.9A)
NDP  O6335 (-3.4A)
None
None
0.85A 3dmtC-1jn0O:
48.9
3dmtC-1jn0O:
44.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jn0 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
A


(Spinacia
oleracea)
no annotation 8 SER O 148
THR O 150
ASN O 152
CYH O 153
HIS O 176
TYR O 311
ASN O 313
TYR O 317
SO4  O6337 (-3.5A)
SO4  O6337 (-3.9A)
None
None
None
None
NDP  O6335 (-3.9A)
NDP  O6335 (-3.4A)
0.36A 3dmtC-1jn0O:
48.9
3dmtC-1jn0O:
44.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1obf GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Achromobacter
xylosoxidans)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER O 153
THR O 155
ASN O 157
CYH O 158
HIS O 181
TYR O 314
ASN O 316
SO4  O 342 (-2.8A)
SO4  O 342 ( 4.4A)
None
None
None
None
None
0.34A 3dmtC-1obfO:
45.2
3dmtC-1obfO:
47.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s2n EXTRACELLULAR
SUBTILISIN-LIKE
SERINE PROTEINASE


(Vibrio sp.
PA-44)
PF00082
(Peptidase_S8)
4 SER A 206
THR A  77
HIS A 225
TYR A  83
None
1.02A 3dmtC-1s2nA:
4.1
3dmtC-1s2nA:
23.01
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.
1t1u CHOLINE
O-ACETYLTRANSFERASE


(Rattus
norvegicus)
PF00755
(Carn_acyltransf)
4 SER A 550
CYH A 584
ASN A 575
TYR A 574
None
0.96A 3dmtC-1t1uA:
undetectable
3dmtC-1t1uA:
20.35
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.
1uw1 ARTIFICIAL
NUCLEOTIDE BINDING
PROTEIN (ANBP)


(synthetic
construct)
no annotation 4 ASN A  32
CYH A  46
ASN A  44
TYR A  43
ADP  A1074 ( 4.9A)
ZN  A1075 (-2.4A)
None
ADP  A1074 (-3.6A)
0.94A 3dmtC-1uw1A:
undetectable
3dmtC-1uw1A:
12.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vc2 GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Thermus
thermophilus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 311
TYR A 315
ASN A 152
TYR A 309
NAD  A 336 (-3.8A)
NAD  A 336 (-3.5A)
None
None
1.00A 3dmtC-1vc2A:
27.8
3dmtC-1vc2A:
46.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vc2 GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Thermus
thermophilus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER A 148
THR A 150
ASN A 152
HIS A 176
TYR A 309
ASN A 311
TYR A 315
None
None
None
None
None
NAD  A 336 (-3.8A)
NAD  A 336 (-3.5A)
0.43A 3dmtC-1vc2A:
27.8
3dmtC-1vc2A:
46.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ywg GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Plasmodium
falciparum)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN O 319
TYR O 323
ASN O 156
TYR O 317
NAD  O 401 (-3.6A)
NAD  O 401 (-3.7A)
None
None
0.95A 3dmtC-1ywgO:
48.3
3dmtC-1ywgO:
50.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ywg GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Plasmodium
falciparum)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER O 152
THR O 154
ASN O 156
CYH O 157
HIS O 180
TYR O 317
ASN O 319
TYR O 323
None
None
None
None
None
None
NAD  O 401 (-3.6A)
NAD  O 401 (-3.7A)
0.33A 3dmtC-1ywgO:
48.3
3dmtC-1ywgO:
50.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2d2i GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Synechococcus
sp.)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 318
TYR A 322
ASN A 158
TYR A 316
NAP  A1341 (-3.9A)
NAP  A1341 (-3.7A)
None
None
0.91A 3dmtC-2d2iA:
49.3
3dmtC-2d2iA:
47.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2d2i GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Synechococcus
sp.)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 154
THR A 156
ASN A 158
CYH A 159
HIS A 182
TYR A 316
ASN A 318
TYR A 322
SO4  A1339 (-2.9A)
SO4  A1339 ( 4.3A)
None
None
None
None
NAP  A1341 (-3.9A)
NAP  A1341 (-3.7A)
0.32A 3dmtC-2d2iA:
49.3
3dmtC-2d2iA:
47.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ep7 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Aquifex
aeolicus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 322
TYR A 326
ASN A 155
TYR A 320
NAD  A 401 (-3.9A)
NAD  A 401 ( 3.7A)
None
None
0.97A 3dmtC-2ep7A:
46.8
3dmtC-2ep7A:
48.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ep7 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Aquifex
aeolicus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 151
THR A 153
ASN A 155
CYH A 156
HIS A 179
TYR A 320
ASN A 322
TYR A 326
None
None
None
None
None
None
NAD  A 401 (-3.9A)
NAD  A 401 ( 3.7A)
0.32A 3dmtC-2ep7A:
46.8
3dmtC-2ep7A:
48.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fy2 CHOLINE
O-ACETYLTRANSFERASE


(Homo sapiens)
PF00755
(Carn_acyltransf)
4 SER A 540
CYH A 574
ASN A 565
TYR A 564
None
0.90A 3dmtC-2fy2A:
undetectable
3dmtC-2fy2A:
19.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2i5p GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1


(Kluyveromyces
marxianus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
6 SER O 148
THR O 150
ASN O 152
CYH O 153
TYR O 311
TYR O 317
None
0.29A 3dmtC-2i5pO:
41.8
3dmtC-2i5pO:
51.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2i5p GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1


(Kluyveromyces
marxianus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
5 SER O 148
THR O 150
TYR O 311
ASN O 313
TYR O 317
None
0.81A 3dmtC-2i5pO:
41.8
3dmtC-2i5pO:
51.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pkq GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
B


(Spinacia
oleracea)
PF00044
(Gp_dh_N)
PF02672
(CP12)
PF02800
(Gp_dh_C)
4 ASN O 313
TYR O 317
ASN O 152
TYR O 311
NDP  O 363 (-4.2A)
NDP  O 363 (-3.7A)
None
None
0.88A 3dmtC-2pkqO:
47.2
3dmtC-2pkqO:
41.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pkq GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
B


(Spinacia
oleracea)
PF00044
(Gp_dh_N)
PF02672
(CP12)
PF02800
(Gp_dh_C)
8 SER O 148
THR O 150
ASN O 152
CYH O 153
HIS O 176
TYR O 311
ASN O 313
TYR O 317
None
None
None
None
None
None
NDP  O 363 (-4.2A)
NDP  O 363 (-3.7A)
0.61A 3dmtC-2pkqO:
47.2
3dmtC-2pkqO:
41.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w5f ENDO-1,4-BETA-XYLANA
SE Y


(Ruminiclostridium
thermocellum)
PF00331
(Glyco_hydro_10)
PF02018
(CBM_4_9)
4 SER A 118
THR A 159
ASN A 157
TYR A 119
None
0.99A 3dmtC-2w5fA:
undetectable
3dmtC-2w5fA:
22.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2x0n GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
GLYCOSOMAL


(Trypanosoma
brucei)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 334
TYR A 338
ASN A 168
TYR A 332
NAD  A 361 (-4.0A)
NAD  A 361 ( 3.8A)
None
None
0.97A 3dmtC-2x0nA:
50.5
3dmtC-2x0nA:
90.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2x0n GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
GLYCOSOMAL


(Trypanosoma
brucei)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 164
THR A 166
ASN A 168
CYH A 169
HIS A 193
TYR A 332
ASN A 334
TYR A 338
SO4  A 360 (-2.6A)
SO4  A 360 ( 4.7A)
None
None
None
None
NAD  A 361 (-4.0A)
NAD  A 361 ( 3.8A)
0.38A 3dmtC-2x0nA:
50.5
3dmtC-2x0nA:
90.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2xf8 D-ERYTHROSE-4-PHOSPH
ATE DEHYDROGENASE


(Escherichia
coli)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
5 SER A 148
THR A 150
ASN A 152
CYH A 153
ASN A 313
SO4  A 500 ( 4.0A)
SO4  A 500 (-3.2A)
None
None
None
0.61A 3dmtC-2xf8A:
42.6
3dmtC-2xf8A:
37.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2xf8 D-ERYTHROSE-4-PHOSPH
ATE DEHYDROGENASE


(Escherichia
coli)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
5 SER A 148
THR A 150
ASN A 152
CYH A 153
HIS A 176
SO4  A 500 ( 4.0A)
SO4  A 500 (-3.2A)
None
None
SO4  A 500 (-4.7A)
1.01A 3dmtC-2xf8A:
42.6
3dmtC-2xf8A:
37.16
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.
3a5r BENZALACETONE
SYNTHASE


(Rheum palmatum)
PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C)
4 ASN A  22
CYH A  23
TYR A  62
ASN A  19
None
0.86A 3dmtC-3a5rA:
undetectable
3dmtC-3a5rA:
23.06
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.
3a74 LYSYL-TRNA
SYNTHETASE


(Geobacillus
stearothermophilus)
PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
4 SER A 478
THR A 476
ASN A 477
TYR A 303
None
0.81A 3dmtC-3a74A:
undetectable
3dmtC-3a74A:
20.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b20 GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE
(NADP+)


(Synechococcus
elongatus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 318
TYR A 322
ASN A 158
TYR A 316
NAD  A 340 (-4.2A)
NAD  A 340 ( 3.6A)
None
None
0.98A 3dmtC-3b20A:
48.9
3dmtC-3b20A:
47.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b20 GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE
(NADP+)


(Synechococcus
elongatus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 154
THR A 156
ASN A 158
CYH A 159
HIS A 182
TYR A 316
ASN A 318
TYR A 322
SO4  A1339 (-2.7A)
SO4  A1339 (-3.7A)
None
None
None
None
NAD  A 340 (-4.2A)
NAD  A 340 ( 3.6A)
0.29A 3dmtC-3b20A:
48.9
3dmtC-3b20A:
47.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3cps GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Cryptosporidium
parvum)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 334
TYR A 338
ASN A 171
TYR A 332
NAD  A 401 (-3.6A)
NAD  A 401 (-3.7A)
None
None
0.96A 3dmtC-3cpsA:
27.9
3dmtC-3cpsA:
50.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3cps GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Cryptosporidium
parvum)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 167
THR A 169
ASN A 171
CYH A 172
HIS A 195
TYR A 332
ASN A 334
TYR A 338
None
None
None
None
None
None
NAD  A 401 (-3.6A)
NAD  A 401 (-3.7A)
0.34A 3dmtC-3cpsA:
27.9
3dmtC-3cpsA:
50.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3doc GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Brucella
abortus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER A 152
THR A 154
ASN A 156
CYH A 157
HIS A 180
TYR A 314
ASN A 316
None
None
None
None
None
None
NAD  A 901 (-3.9A)
0.41A 3dmtC-3docA:
47.7
3dmtC-3docA:
47.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3e6a GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
CYTOSOLIC


(Oryza sativa)
no annotation 8 SER O 153
THR O 155
ASN O 157
CYH O 158
HIS O 181
TYR O 316
ASN O 318
TYR O 322
SO4  O6921 (-2.4A)
SO4  O6921 (-3.9A)
None
None
None
None
None
None
0.49A 3dmtC-3e6aO:
47.9
3dmtC-3e6aO:
55.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gnq GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE, TYPE
I


(Burkholderia
pseudomallei)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER A 153
THR A 155
ASN A 157
CYH A 158
HIS A 181
TYR A 314
ASN A 316
None
0.36A 3dmtC-3gnqA:
46.5
3dmtC-3gnqA:
49.19
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.
3hbd CLASS IV CHITINASE
CHIA4-PA2


(Picea abies)
PF00182
(Glyco_hydro_19)
4 SER A 153
TYR A 156
ASN A 155
TYR A 158
ACT  A 310 (-3.2A)
None
None
None
1.01A 3dmtC-3hbdA:
undetectable
3dmtC-3hbdA:
19.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3hja GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Borreliella
burgdorferi)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 318
TYR A 322
ASN A 156
TYR A 316
NAD  A 337 (-3.7A)
NAD  A 337 (-3.6A)
None
None
0.98A 3dmtC-3hjaA:
47.1
3dmtC-3hjaA:
45.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3hja GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Borreliella
burgdorferi)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 152
THR A 154
ASN A 156
CYH A 157
HIS A 180
TYR A 316
ASN A 318
TYR A 322
SO4  A 336 (-3.2A)
SO4  A 336 (-3.3A)
None
None
SO4  A 336 (-4.4A)
None
NAD  A 337 (-3.7A)
NAD  A 337 (-3.6A)
0.24A 3dmtC-3hjaA:
47.1
3dmtC-3hjaA:
45.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k2b GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
A, CHLOROPLASTIC


(Arabidopsis
thaliana)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 313
TYR A 317
ASN A 152
TYR A 311
NAD  A 335 (-3.9A)
NAD  A 335 (-3.5A)
None
None
1.02A 3dmtC-3k2bA:
48.9
3dmtC-3k2bA:
44.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k2b GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
A, CHLOROPLASTIC


(Arabidopsis
thaliana)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 148
THR A 150
ASN A 152
CYH A 153
HIS A 176
TYR A 311
ASN A 313
TYR A 317
SO4  A 337 (-3.1A)
SO4  A 337 ( 4.2A)
None
None
None
None
NAD  A 335 (-3.9A)
NAD  A 335 (-3.5A)
0.33A 3dmtC-3k2bA:
48.9
3dmtC-3k2bA:
44.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ksd GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1


(Staphylococcus
aureus)
no annotation 6 SER Q 150
THR Q 152
ASN Q 154
TYR Q 314
ASN Q 316
TYR Q 320
None
None
None
None
NAD  Q 337 (-3.8A)
NAD  Q 337 ( 3.8A)
0.23A 3dmtC-3ksdQ:
47.0
3dmtC-3ksdQ:
42.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l0d GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Bartonella
henselae)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER A 152
THR A 154
ASN A 156
CYH A 157
HIS A 180
TYR A 314
ASN A 316
None
None
None
None
None
None
NAD  A 336 (-3.9A)
0.33A 3dmtC-3l0dA:
47.4
3dmtC-3l0dA:
44.41
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.
3nqh GLYCOSYL HYDROLASE

(Bacteroides
thetaiotaomicron)
PF04616
(Glyco_hydro_43)
4 SER A 261
THR A 258
ASN A 260
ASN A 231
None
0.98A 3dmtC-3nqhA:
undetectable
3dmtC-3nqhA:
22.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pym GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
3


(Saccharomyces
cerevisiae)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 314
TYR A 318
ASN A 153
TYR A 312
NAD  A 333 (-3.7A)
NAD  A 333 (-3.6A)
None
None
0.97A 3dmtC-3pymA:
48.8
3dmtC-3pymA:
51.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pym GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
3


(Saccharomyces
cerevisiae)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 149
THR A 151
ASN A 153
CYH A 154
HIS A 177
TYR A 312
ASN A 314
TYR A 318
None
None
None
None
None
None
NAD  A 333 (-3.7A)
NAD  A 333 (-3.6A)
0.29A 3dmtC-3pymA:
48.8
3dmtC-3pymA:
51.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3sth GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Toxoplasma
gondii)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 319
TYR A 323
ASN A 155
TYR A 317
NAD  A 380 (-3.8A)
NAD  A 380 (-3.6A)
None
None
0.96A 3dmtC-3sthA:
49.1
3dmtC-3sthA:
48.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3sth GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Toxoplasma
gondii)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 151
THR A 153
ASN A 155
CYH A 156
HIS A 179
TYR A 317
ASN A 319
TYR A 323
None
None
None
None
None
None
NAD  A 380 (-3.8A)
NAD  A 380 (-3.6A)
0.28A 3dmtC-3sthA:
49.1
3dmtC-3sthA:
48.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zdf GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Thermosynechococcus
elongatus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 317
TYR A 321
ASN A 157
TYR A 315
NAD  A1001 (-3.7A)
NAD  A1001 (-3.5A)
None
None
0.94A 3dmtC-3zdfA:
48.9
3dmtC-3zdfA:
47.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zdf GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Thermosynechococcus
elongatus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 153
THR A 155
ASN A 157
CYH A 158
HIS A 181
TYR A 315
ASN A 317
TYR A 321
None
None
None
None
None
None
NAD  A1001 (-3.7A)
NAD  A1001 (-3.5A)
0.27A 3dmtC-3zdfA:
48.9
3dmtC-3zdfA:
47.07
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.
4cvu BETA-MANNOSIDASE

(Trichoderma
harzianum)
PF00703
(Glyco_hydro_2)
4 THR A 642
ASN A 626
HIS A 639
ASN A 640
NAG  A1943 (-4.4A)
None
None
NAG  A1975 (-1.9A)
0.94A 3dmtC-4cvuA:
undetectable
3dmtC-4cvuA:
18.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4dib GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Bacillus
anthracis)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 314
TYR A 318
ASN A 154
TYR A 312
None
0.99A 3dmtC-4dibA:
43.6
3dmtC-4dibA:
45.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4dib GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Bacillus
anthracis)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER A 150
THR A 152
ASN A 154
CYH A 155
HIS A 178
TYR A 312
TYR A 318
None
0.72A 3dmtC-4dibA:
43.6
3dmtC-4dibA:
45.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4dib GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Bacillus
anthracis)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
7 SER A 150
THR A 152
ASN A 154
CYH A 155
TYR A 312
ASN A 314
TYR A 318
None
0.23A 3dmtC-4dibA:
43.6
3dmtC-4dibA:
45.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gpd APO-D-GLYCERALDEHYDE
-3-PHOSPHATE
DEHYDROGENASE


(Homarus
americanus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN 1 312
TYR 1 316
ASN 1 151
TYR 1 310
None
1.01A 3dmtC-4gpd1:
25.2
3dmtC-4gpd1:
55.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gpd APO-D-GLYCERALDEHYDE
-3-PHOSPHATE
DEHYDROGENASE


(Homarus
americanus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER 1 147
THR 1 149
ASN 1 151
CYH 1 152
HIS 1 175
TYR 1 310
ASN 1 312
TYR 1 316
None
0.65A 3dmtC-4gpd1:
25.2
3dmtC-4gpd1:
55.74
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.
4igi COLLAGEN ALPHA3(VI)

(Mus musculus)
PF00092
(VWA)
4 SER A1141
THR A1105
ASN A1104
TYR A1069
None
0.81A 3dmtC-4igiA:
4.1
3dmtC-4igiA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ij4 CHITINASE A

(Gemmabryum
coronatum)
PF00182
(Glyco_hydro_19)
4 SER A 102
TYR A 105
ASN A 104
TYR A 107
NAG  A 303 (-3.5A)
EDO  A 308 (-3.6A)
EDO  A 307 ( 4.5A)
None
1.02A 3dmtC-4ij4A:
undetectable
3dmtC-4ij4A:
19.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4k9d GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Brugia malayi)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 321
TYR A 325
ASN A 160
TYR A 319
NAD  A 401 (-3.9A)
NAD  A 401 (-3.6A)
None
None
0.95A 3dmtC-4k9dA:
50.0
3dmtC-4k9dA:
52.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4k9d GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Brugia malayi)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 156
THR A 158
ASN A 160
CYH A 161
HIS A 184
TYR A 319
ASN A 321
TYR A 325
None
None
None
None
None
None
NAD  A 401 (-3.9A)
NAD  A 401 (-3.6A)
0.27A 3dmtC-4k9dA:
50.0
3dmtC-4k9dA:
52.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lsm GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE,
CYTOSOLIC


(Trypanosoma
cruzi)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 320
TYR A 324
ASN A 159
TYR A 318
NAD  A 401 (-3.7A)
NAD  A 401 (-3.6A)
None
None
0.92A 3dmtC-4lsmA:
49.3
3dmtC-4lsmA:
49.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lsm GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE,
CYTOSOLIC


(Trypanosoma
cruzi)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 155
THR A 157
ASN A 159
CYH A 160
HIS A 183
TYR A 318
ASN A 320
TYR A 324
None
None
None
None
None
None
NAD  A 401 (-3.7A)
NAD  A 401 (-3.6A)
0.30A 3dmtC-4lsmA:
49.3
3dmtC-4lsmA:
49.87
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.
4mst CLASS I CHITINASE

(Hevea
brasiliensis)
PF00182
(Glyco_hydro_19)
4 SER A 170
TYR A 173
ASN A 172
TYR A 175
None
1.01A 3dmtC-4mstA:
undetectable
3dmtC-4mstA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nqf NUCLEOTIDYLTRANSFERA
SE


(Agrobacterium
fabrum)
PF05168
(HEPN)
4 SER A 213
HIS A 163
ASN A 211
TYR A 212
None
0.78A 3dmtC-4nqfA:
undetectable
3dmtC-4nqfA:
17.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o59 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Bos taurus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN O 313
TYR O 317
ASN O 152
TYR O 311
NAD  O 401 (-3.8A)
NAD  O 401 (-3.5A)
None
None
0.96A 3dmtC-4o59O:
48.8
3dmtC-4o59O:
52.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o59 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Bos taurus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER O 148
THR O 150
ASN O 152
CYH O 153
HIS O 176
TYR O 311
ASN O 313
TYR O 317
None
None
None
None
None
None
NAD  O 401 (-3.8A)
NAD  O 401 (-3.5A)
0.30A 3dmtC-4o59O:
48.8
3dmtC-4o59O:
52.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p8r GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE,
CYTOSOLIC


(Trypanosoma
brucei)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN A 314
TYR A 318
ASN A 153
TYR A 312
NAD  A 400 (-3.7A)
NAD  A 400 (-3.6A)
None
None
0.96A 3dmtC-4p8rA:
48.8
3dmtC-4p8rA:
51.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p8r GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE,
CYTOSOLIC


(Trypanosoma
brucei)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 149
THR A 151
ASN A 153
CYH A 154
HIS A 177
TYR A 312
ASN A 314
TYR A 318
None
None
None
None
None
None
NAD  A 400 (-3.7A)
NAD  A 400 (-3.6A)
0.31A 3dmtC-4p8rA:
48.8
3dmtC-4p8rA:
51.25
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.
4pu5 TOXIN-ANTITOXIN
SYSTEM TOXIN HIPA
FAMILY


(Shewanella
oneidensis)
PF07804
(HipA_C)
PF13657
(Couple_hipA)
4 SER A 313
CYH A 242
ASN A 311
TYR A 312
ANP  A 503 ( 4.2A)
None
MG  A 502 ( 2.5A)
None
1.00A 3dmtC-4pu5A:
undetectable
3dmtC-4pu5A:
25.41
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.
4q4y COXSACKIEVIRUS
CAPSID PROTEIN VP2


(Enterovirus C)
PF00073
(Rhv)
4 SER 2 164
THR 2 136
ASN 2 135
CYH 2 134
None
0.96A 3dmtC-4q4y2:
undetectable
3dmtC-4q4y2:
19.22
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.
4x6k ANHYDROSIALIDASE

([Ruminococcus]
gnavus)
PF13088
(BNR_2)
4 SER A 411
THR A 409
ASN A 410
TYR A 405
None
0.99A 3dmtC-4x6kA:
undetectable
3dmtC-4x6kA:
21.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4z0h GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
GAPC1, CYTOSOLIC


(Arabidopsis
thaliana)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN O 313
TYR O 317
ASN O 152
TYR O 311
NAD  O 401 (-3.8A)
NAD  O 401 (-3.7A)
None
None
0.95A 3dmtC-4z0hO:
48.5
3dmtC-4z0hO:
55.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4z0h GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
GAPC1, CYTOSOLIC


(Arabidopsis
thaliana)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER O 148
THR O 150
ASN O 152
CYH O 153
HIS O 176
TYR O 311
ASN O 313
TYR O 317
SO4  O 403 (-2.8A)
SO4  O 403 (-4.0A)
None
None
None
None
NAD  O 401 (-3.8A)
NAD  O 401 (-3.7A)
0.25A 3dmtC-4z0hO:
48.5
3dmtC-4z0hO:
55.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c7i GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
TESTIS-SPECIFIC


(Mus musculus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN O 420
TYR O 424
ASN O 259
TYR O 418
None
0.97A 3dmtC-5c7iO:
48.6
3dmtC-5c7iO:
51.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c7i GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
TESTIS-SPECIFIC


(Mus musculus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER O 255
THR O 257
ASN O 259
CYH O 260
HIS O 283
TYR O 418
ASN O 420
TYR O 424
None
0.35A 3dmtC-5c7iO:
48.6
3dmtC-5c7iO:
51.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c7o GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
TESTIS-SPECIFIC


(Homo sapiens)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
4 ASN O 388
TYR O 392
ASN O 227
TYR O 386
NAD  O 501 (-3.9A)
NAD  O 501 (-2.7A)
OCS  O 224 ( 4.8A)
OCS  O 224 ( 4.0A)
0.94A 3dmtC-5c7oO:
49.8
3dmtC-5c7oO:
52.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c7o GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
TESTIS-SPECIFIC


(Homo sapiens)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER O 223
THR O 225
ASN O 227
CYH O 228
HIS O 251
TYR O 386
ASN O 388
TYR O 392
OCS  O 224 ( 3.4A)
OCS  O 224 ( 4.2A)
OCS  O 224 ( 4.8A)
None
OCS  O 224 ( 3.9A)
OCS  O 224 ( 4.0A)
NAD  O 501 (-3.9A)
NAD  O 501 (-2.7A)
0.24A 3dmtC-5c7oO:
49.8
3dmtC-5c7oO:
52.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cyf PUTATIVE URIDINE
PHOSPHORYLASE


(Schistosoma
mansoni)
PF01048
(PNP_UDP_1)
4 THR A 239
ASN A 243
CYH A 242
ASN A 150
None
0.97A 3dmtC-5cyfA:
2.1
3dmtC-5cyfA:
21.31
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.
5h7t CLASS IV CHITINASE

(Cryptomeria
japonica)
no annotation 4 SER A 107
TYR A 110
ASN A 109
TYR A 112
None
0.86A 3dmtC-5h7tA:
undetectable
3dmtC-5h7tA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hj2 INTEGRIN ALPHA-2

(Homo sapiens)
no annotation 4 SER C 121
THR C  87
ASN C  86
TYR C  51
None
0.89A 3dmtC-5hj2C:
4.4
3dmtC-5hj2C:
21.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5j9g GLYCERALDEHYDE-3-P
DEHYDROGENASE


(Lactobacillus
acidophilus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
6 SER A 155
THR A 157
ASN A 159
HIS A 183
TYR A 318
ASN A 320
None
0.40A 3dmtC-5j9gA:
45.2
3dmtC-5j9gA:
41.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ld5 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Atopobium
vaginae)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 167
THR A 169
ASN A 171
CYH A 172
HIS A 195
TYR A 334
ASN A 336
TYR A 340
GOL  A 404 (-3.0A)
GOL  A 404 ( 4.8A)
None
None
None
None
NAD  A 401 (-4.1A)
NAD  A 401 (-3.8A)
0.35A 3dmtC-5ld5A:
44.4
3dmtC-5ld5A:
41.05
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.
5the UNCHARACTERIZED
PROTEIN


(Vanderwaltozyma
polyspora)
no annotation 4 SER A1143
ASN A1175
CYH A1174
TYR A1156
None
0.95A 3dmtC-5theA:
3.9
3dmtC-5theA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ur0 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Naegleria
gruberi)
no annotation 4 ASN A 314
TYR A 318
ASN A 152
TYR A 312
NAD  A 401 (-3.7A)
NAD  A 401 (-3.5A)
None
OCS  A 149 ( 4.1A)
0.94A 3dmtC-5ur0A:
49.7
3dmtC-5ur0A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ur0 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Naegleria
gruberi)
no annotation 8 SER A 148
THR A 150
ASN A 152
CYH A 153
HIS A 176
TYR A 312
ASN A 314
TYR A 318
OCS  A 149 ( 3.5A)
OCS  A 149 ( 3.8A)
None
None
OCS  A 149 ( 4.0A)
OCS  A 149 ( 4.1A)
NAD  A 401 (-3.7A)
NAD  A 401 (-3.5A)
0.24A 3dmtC-5ur0A:
49.7
3dmtC-5ur0A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vha DEAH
(ASP-GLU-ALA-HIS)
BOX POLYPEPTIDE 36


(Bos taurus)
no annotation 4 SER A 291
THR A 292
ASN A 290
CYH A 286
None
0.90A 3dmtC-5vhaA:
2.2
3dmtC-5vhaA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5vmt GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Neisseria
gonorrhoeae)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
8 SER A 150
THR A 152
ASN A 154
CYH A 155
HIS A 178
TYR A 313
ASN A 315
TYR A 319
None
None
None
None
None
None
NAD  A 401 (-3.7A)
NAD  A 401 (-3.5A)
0.38A 3dmtC-5vmtA:
47.2
3dmtC-5vmtA:
44.90
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.
5y37 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Streptococcus
agalactiae)
no annotation 4 ASN A 320
TYR A 324
ASN A 159
TYR A 318
NAD  A 401 (-3.7A)
NAD  A 401 (-3.6A)
None
None
1.00A 3dmtC-5y37A:
46.7
3dmtC-5y37A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y37 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Streptococcus
agalactiae)
no annotation 8 SER A 155
THR A 157
ASN A 159
CYH A 160
HIS A 183
TYR A 318
ASN A 320
TYR A 324
None
None
None
None
None
None
NAD  A 401 (-3.7A)
NAD  A 401 (-3.6A)
0.36A 3dmtC-5y37A:
46.7
3dmtC-5y37A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dfz GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Acropora
millepora)
no annotation 4 ASN A 315
TYR A 319
ASN A 154
TYR A 313
NAD  A 401 (-4.0A)
NAD  A 401 (-3.6A)
None
None
0.99A 3dmtC-6dfzA:
27.4
3dmtC-6dfzA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dfz GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Acropora
millepora)
no annotation 8 SER A 150
THR A 152
ASN A 154
CYH A 155
HIS A 178
TYR A 313
ASN A 315
TYR A 319
PO4  A 402 (-2.7A)
PO4  A 402 (-3.1A)
None
None
PO4  A 402 (-4.0A)
None
NAD  A 401 (-4.0A)
NAD  A 401 (-3.6A)
0.23A 3dmtC-6dfzA:
27.4
3dmtC-6dfzA:
undetectable