SIMILAR PATTERNS OF AMINO ACIDS FOR 4IQQ_A_D16A402

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.
1am5 PEPSIN

(Gadus morhua)
PF00026
(Asp)
5 ASP A 303
LEU A 306
GLY A 302
PHE A 301
TYR A  14
None
1.23A 4iqqA-1am5A:
0.0
4iqqA-1am5A:
22.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1bsf THYMIDYLATE SYNTHASE
A


(Bacillus
subtilis)
PF00303
(Thymidylat_synt)
5 ILE A  93
ASP A 184
GLY A 188
PHE A 191
TYR A 224
None
0.73A 4iqqA-1bsfA:
30.8
4iqqA-1bsfA:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ci7 PROTEIN (THYMIDYLATE
SYNTHASE)


(Pneumocystis
carinii)
PF00303
(Thymidylat_synt)
6 ILE A  86
ASP A 202
LEU A 205
GLY A 206
PHE A 209
TYR A 242
CB3  A 768 (-3.6A)
CB3  A 768 ( 3.6A)
CB3  A 768 ( 4.4A)
UMP  A 767 (-3.7A)
CB3  A 768 (-3.6A)
CB3  A 768 ( 4.7A)
0.66A 4iqqA-1ci7A:
41.2
4iqqA-1ci7A:
53.11
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.
1cov COXSACKIEVIRUS COAT
PROTEIN


(Enterovirus B)
PF00073
(Rhv)
4 ILE 3 114
LEU 3 104
GLY 3 101
PHE 3  95
None
0.78A 4iqqA-1cov3:
undetectable
4iqqA-1cov3:
18.81
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.
1d6h CHALCONE SYNTHASE

(Medicago sativa)
PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C)
4 ILE A 114
LEU A 150
GLY A 149
TYR A 153
None
0.88A 4iqqA-1d6hA:
undetectable
4iqqA-1d6hA:
20.19
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.
1d6n PROTEIN
(HYPOXANTHINE-GUANIN
E
PHOSPHORIBOSYLTRANSF
ERASE)


(Homo sapiens)
PF00156
(Pribosyltran)
4 TYR A 194
ILE A 207
GLY A 189
PHE A 198
None
0.82A 4iqqA-1d6nA:
0.0
4iqqA-1d6nA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d7e PHOTOACTIVE YELLOW
PROTEIN


(Halorhodospira
halophila)
PF00989
(PAS)
5 TYR A  42
ILE A  31
ASP A  34
GLY A  37
PHE A  62
HC4  A 126 (-4.2A)
None
None
None
HC4  A 126 (-4.7A)
1.47A 4iqqA-1d7eA:
undetectable
4iqqA-1d7eA:
18.21
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.
1eg7 FORMYLTETRAHYDROFOLA
TE SYNTHETASE


(Moorella
thermoacetica)
PF01268
(FTHFS)
4 ILE A1060
ASP A1056
LEU A1292
GLY A1057
None
0.91A 4iqqA-1eg7A:
0.0
4iqqA-1eg7A:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g6q HNRNP ARGININE
N-METHYLTRANSFERASE


(Saccharomyces
cerevisiae)
PF06325
(PrmA)
4 TYR 1 178
ILE 1 206
LEU 1 173
GLY 1 253
None
0.80A 4iqqA-1g6q1:
0.0
4iqqA-1g6q1:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gxl CHROMOSOME
SEGREGATION SMC
PROTEIN


(Thermotoga
maritima)
PF06470
(SMC_hinge)
4 ILE A 524
LEU A 609
GLY A 610
PHE A 614
None
0.88A 4iqqA-1gxlA:
undetectable
4iqqA-1gxlA:
22.18
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.
1hkk CHITOTRIOSIDASE-1

(Homo sapiens)
PF00704
(Glyco_hydro_18)
4 ILE A 325
LEU A 301
GLY A 268
PHE A 334
None
0.90A 4iqqA-1hkkA:
undetectable
4iqqA-1hkkA:
23.18
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.
1htw HI0065

(Haemophilus
influenzae)
PF02367
(TsaE)
4 ILE A  24
ASP A 126
LEU A 148
GLY A 149
None
0.93A 4iqqA-1htwA:
undetectable
4iqqA-1htwA:
21.96
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.
1hv5 STROMELYSIN 3

(Mus musculus)
PF00413
(Peptidase_M10)
4 ILE A 159
LEU A 225
GLY A 222
PHE A 221
None
0.85A 4iqqA-1hv5A:
undetectable
4iqqA-1hv5A:
20.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvy THYMIDYLATE SYNTHASE

(Homo sapiens)
PF00303
(Thymidylat_synt)
6 ILE A 108
ASP A 218
LEU A 221
GLY A 222
PHE A 225
TYR A 258
D16  A 414 (-3.7A)
D16  A 414 ( 3.6A)
D16  A 414 (-4.0A)
D16  A 414 (-3.3A)
D16  A 414 (-3.6A)
UMP  A 314 ( 4.4A)
0.57A 4iqqA-1hvyA:
42.1
4iqqA-1hvyA:
62.22
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.
1ize ASPARTIC PROTEINASE

(Aspergillus
oryzae)
PF00026
(Asp)
5 ASP A 300
LEU A 303
GLY A 299
PHE A 298
TYR A  17
None
1.19A 4iqqA-1izeA:
undetectable
4iqqA-1izeA:
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.
1j1w ISOCITRATE
DEHYDROGENASE


(Azotobacter
vinelandii)
PF03971
(IDH)
4 ASP A 655
GLY A 658
PHE A 661
TYR A 598
None
0.88A 4iqqA-1j1wA:
undetectable
4iqqA-1j1wA:
19.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1j3j BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Plasmodium
falciparum)
PF00303
(Thymidylat_synt)
4 ASP C 513
LEU C 516
GLY C 517
TYR C 553
UMP  C 611 (-4.9A)
None
UMP  C 611 (-3.5A)
UMP  C 611 (-4.9A)
0.70A 4iqqA-1j3jC:
40.0
4iqqA-1j3jC:
49.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1j3j BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Plasmodium
falciparum)
PF00303
(Thymidylat_synt)
4 ILE C 403
ASP C 513
GLY C 517
TYR C 553
None
UMP  C 611 (-4.9A)
UMP  C 611 (-3.5A)
UMP  C 611 (-4.9A)
0.52A 4iqqA-1j3jC:
40.0
4iqqA-1j3jC:
49.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j8s PYELONEPHRITIC
ADHESIN


(Escherichia
coli)
PF03627
(PapG_N)
4 TYR A   7
ASP A  11
LEU A   9
GLY A  10
None
0.90A 4iqqA-1j8sA:
undetectable
4iqqA-1j8sA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mdu GELSOLIN PRECURSOR

(Homo sapiens)
PF00626
(Gelsolin)
4 TYR A 109
ILE A  46
LEU A 114
GLY A  36
None
None
None
TRS  A 472 ( 4.7A)
0.92A 4iqqA-1mduA:
undetectable
4iqqA-1mduA:
19.45
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.
1mzu PPR

(Rhodospirillum
centenum)
PF00989
(PAS)
5 TYR A  42
ILE A  31
ASP A  34
GLY A  37
PHE A  62
HC4  A 130 (-4.6A)
None
None
None
None
1.49A 4iqqA-1mzuA:
undetectable
4iqqA-1mzuA:
17.32
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.
1n71 AAC(6')-II

(Enterococcus
faecium)
PF00583
(Acetyltransf_1)
4 TYR A 144
ILE A 154
LEU A 109
GLY A 110
None
0.71A 4iqqA-1n71A:
undetectable
4iqqA-1n71A:
18.94
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.
1odv PHOTOACTIVE YELLOW
PROTEIN


(Halorhodospira
halophila)
PF00989
(PAS)
5 TYR A  42
ILE A  31
ASP A  34
GLY A  37
PHE A  62
HC4  A 126 (-4.2A)
None
None
None
HC4  A 126 ( 4.9A)
1.49A 4iqqA-1odvA:
undetectable
4iqqA-1odvA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pmj BETA-1,4-MANNANASE

(Caldicellulosiruptor
saccharolyticus)
PF09212
(CBM27)
4 ILE X 173
ASP X  61
GLY X 164
PHE X 103
None
0.89A 4iqqA-1pmjX:
undetectable
4iqqA-1pmjX:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q6y HYPOTHETICAL PROTEIN
YFDW


(Escherichia
coli)
PF02515
(CoA_transf_3)
4 TYR A 225
ASP A 239
GLY A 238
PHE A 237
None
0.82A 4iqqA-1q6yA:
undetectable
4iqqA-1q6yA:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qox BETA-GLUCOSIDASE

(Bacillus
circulans)
PF00232
(Glyco_hydro_1)
5 TYR A 146
ILE A  80
ASP A  99
LEU A  98
GLY A  97
None
1.25A 4iqqA-1qoxA:
undetectable
4iqqA-1qoxA:
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.
1rgi GELSOLIN

(Equus caballus)
PF00626
(Gelsolin)
4 TYR G 133
ILE G  70
LEU G 138
GLY G  60
None
0.89A 4iqqA-1rgiG:
undetectable
4iqqA-1rgiG:
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.
1rhy IMIDAZOLE GLYCEROL
PHOSPHATE
DEHYDRATASE


(Cryptococcus
neoformans)
PF00475
(IGPD)
4 ILE A 181
LEU A  81
GLY A  82
PHE A  85
None
0.80A 4iqqA-1rhyA:
undetectable
4iqqA-1rhyA:
21.67
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.
1rtr GERANYLTRANSTRANSFER
ASE


(Staphylococcus
aureus)
PF00348
(polyprenyl_synt)
4 ILE A  45
LEU A 210
GLY A 211
PHE A 214
None
0.55A 4iqqA-1rtrA:
undetectable
4iqqA-1rtrA:
25.07
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.
1s4e GALACTOKINASE

(Pyrococcus
furiosus)
PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg)
4 ILE A 164
ASP A 151
LEU A 150
PHE A 153
None
GLA  A 500 (-3.0A)
GLA  A 500 ( 4.4A)
None
0.89A 4iqqA-1s4eA:
undetectable
4iqqA-1s4eA:
22.94
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.
1sb3 4-HYDROXYBENZOYL-COA
REDUCTASE ALPHA
SUBUNIT


(Thauera
aromatica)
PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2)
4 ILE A 534
ASP A 714
GLY A 720
PHE A 719
None
0.89A 4iqqA-1sb3A:
undetectable
4iqqA-1sb3A:
17.53
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.
1sxr PEPTIDOGLYCAN
RECOGNITION PROTEIN
SA CG11709-PA


(Drosophila
melanogaster)
PF01510
(Amidase_2)
4 TYR A  76
ILE A  74
GLY A  91
TYR A  30
EDO  A 404 (-4.4A)
None
None
None
0.75A 4iqqA-1sxrA:
undetectable
4iqqA-1sxrA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t3q QUINOLINE
2-OXIDOREDUCTASE
LARGE SUBUNIT


(Pseudomonas
putida)
PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2)
4 TYR B 348
ILE B 386
LEU B 315
PHE B 312
None
0.89A 4iqqA-1t3qB:
undetectable
4iqqA-1t3qB:
17.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tis THYMIDYLATE SYNTHASE

(Escherichia
virus T4)
PF00303
(Thymidylat_synt)
4 ASP A 179
GLY A 183
PHE A 186
TYR A 219
None
0.52A 4iqqA-1tisA:
30.4
4iqqA-1tisA:
39.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tis THYMIDYLATE SYNTHASE

(Escherichia
virus T4)
PF00303
(Thymidylat_synt)
4 ASP A 179
LEU A 182
GLY A 183
TYR A 219
None
0.57A 4iqqA-1tisA:
30.4
4iqqA-1tisA:
39.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uky URIDYLATE KINASE

(Saccharomyces
cerevisiae)
PF00406
(ADK)
4 TYR A  40
ILE A 200
ASP A 103
PHE A  42
None
None
ADP  A 205 ( 4.9A)
None
0.93A 4iqqA-1ukyA:
undetectable
4iqqA-1ukyA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1upn ECHOVIRUS 11 COAT
PROTEIN VP3


(Enterovirus B)
PF00073
(Rhv)
4 ILE C 114
LEU C 104
GLY C 101
PHE C  95
None
0.89A 4iqqA-1upnC:
undetectable
4iqqA-1upnC:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vgm 378AA LONG
HYPOTHETICAL CITRATE
SYNTHASE


(Sulfurisphaera
tokodaii)
PF00285
(Citrate_synt)
4 TYR A 310
ASP A 314
GLY A 256
PHE A 257
None
GOL  A 401 ( 4.5A)
None
None
0.77A 4iqqA-1vgmA:
undetectable
4iqqA-1vgmA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vgp 373AA LONG
HYPOTHETICAL CITRATE
SYNTHASE


(Sulfurisphaera
tokodaii)
PF00285
(Citrate_synt)
4 TYR A 306
ASP A 310
GLY A 251
PHE A 252
None
0.88A 4iqqA-1vgpA:
undetectable
4iqqA-1vgpA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vrm HYPOTHETICAL PROTEIN
TM1553


(Thermotoga
maritima)
PF02424
(ApbE)
5 TYR A 196
ILE A  82
ASP A 188
LEU A 189
GLY A 190
None
None
UNL  A   4 (-3.2A)
None
UNL  A   4 (-3.8A)
1.36A 4iqqA-1vrmA:
undetectable
4iqqA-1vrmA:
20.33
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.
1x40 ARAP2

(Homo sapiens)
PF00536
(SAM_1)
4 TYR A  30
ILE A  67
ASP A  20
PHE A  34
None
0.90A 4iqqA-1x40A:
undetectable
4iqqA-1x40A:
15.83
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.
1yw1 PROTEIN YTNJ

(Bacillus
subtilis)
PF00296
(Bac_luciferase)
5 ILE A 374
ASP A 384
GLY A 385
PHE A   9
TYR A 248
None
1.49A 4iqqA-1yw1A:
undetectable
4iqqA-1yw1A:
20.45
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.
1z7m ATP
PHOSPHORIBOSYLTRANSF
ERASE REGULATORY
SUBUNIT


(Lactococcus
lactis)
PF13393
(tRNA-synt_His)
4 ILE A 129
GLY A 288
PHE A 307
TYR A 268
None
0.77A 4iqqA-1z7mA:
undetectable
4iqqA-1z7mA:
21.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2aaz THYMIDYLATE SYNTHASE

(Cryptococcus
neoformans)
PF00303
(Thymidylat_synt)
6 ILE A 100
ASP A 219
LEU A 222
GLY A 223
PHE A 226
TYR A 259
CB3  A2351 (-3.6A)
CB3  A2351 ( 3.6A)
CB3  A2351 (-4.1A)
CB3  A2351 ( 3.2A)
CB3  A2351 (-3.8A)
CB3  A2351 ( 4.3A)
1.02A 4iqqA-2aazA:
undetectable
4iqqA-2aazA:
49.39
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.
2amy PHOSPHOMANNOMUTASE 2

(Homo sapiens)
PF03332
(PMM)
4 ILE A 240
ASP A 209
GLY A 208
PHE A 207
None
0.84A 4iqqA-2amyA:
undetectable
4iqqA-2amyA:
21.34
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.
2bg9 ACETYLCHOLINE
RECEPTOR PROTEIN,
GAMMA CHAIN


(Torpedo
marmorata)
PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb)
4 ILE E 209
ASP E 173
LEU E 212
PHE E 211
None
0.92A 4iqqA-2bg9E:
undetectable
4iqqA-2bg9E:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2exr CYTOKININ
DEHYDROGENASE 7


(Arabidopsis
thaliana)
PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind)
4 ILE A 339
ASP A 272
LEU A 320
GLY A 319
None
0.86A 4iqqA-2exrA:
undetectable
4iqqA-2exrA:
20.45
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.
2ff6 GELSOLIN

(Homo sapiens)
PF00626
(Gelsolin)
4 TYR G 133
ILE G  70
LEU G 138
GLY G  60
None
0.91A 4iqqA-2ff6G:
undetectable
4iqqA-2ff6G:
18.50
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.
2fqd BLUE COPPER OXIDASE
CUEO


(Escherichia
coli)
PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3)
4 ILE A 447
LEU A 512
GLY A 513
PHE A 514
None
0.86A 4iqqA-2fqdA:
undetectable
4iqqA-2fqdA:
21.59
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.
2gxf HYPOTHETICAL PROTEIN
YYBH


(Bacillus
subtilis)
PF13474
(SnoaL_3)
4 TYR A 104
ILE A   9
LEU A  72
PHE A 106
MES  A 201 (-3.3A)
MES  A 201 (-4.2A)
None
MES  A 201 (-4.7A)
0.85A 4iqqA-2gxfA:
undetectable
4iqqA-2gxfA:
17.83
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.
2h12 CITRATE SYNTHASE

(Acetobacter
aceti)
PF00285
(Citrate_synt)
4 TYR A 367
ASP A 371
GLY A 310
PHE A 311
None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
0.78A 4iqqA-2h12A:
undetectable
4iqqA-2h12A:
22.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2h2q BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Trypanosoma
cruzi)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
5 ASP A 426
LEU A 429
GLY A 430
PHE A 433
TYR A 466
None
None
DU  A 611 (-3.5A)
None
DU  A 611 (-4.6A)
0.75A 4iqqA-2h2qA:
41.0
4iqqA-2h2qA:
36.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2h2q BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Trypanosoma
cruzi)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
5 ILE A 316
ASP A 426
GLY A 430
PHE A 433
TYR A 466
None
None
DU  A 611 (-3.5A)
None
DU  A 611 (-4.6A)
0.49A 4iqqA-2h2qA:
41.0
4iqqA-2h2qA:
36.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hh6 BH3980 PROTEIN

(Bacillus
halodurans)
PF06304
(DUF1048)
5 ILE A  38
ASP A  63
LEU A  62
GLY A  59
PHE A  58
None
1.30A 4iqqA-2hh6A:
undetectable
4iqqA-2hh6A:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i53 CYCLIN K

(Homo sapiens)
PF00134
(Cyclin_N)
PF02984
(Cyclin_C)
4 ILE A 117
ASP A 134
GLY A 133
PHE A 132
None
0.89A 4iqqA-2i53A:
undetectable
4iqqA-2i53A:
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.
2idv EUKARYOTIC
TRANSLATION
INITIATION FACTOR
4E-1


(Triticum
aestivum)
PF01652
(IF4E)
4 ILE A 166
ASP A 148
GLY A 147
PHE A 144
None
0.76A 4iqqA-2idvA:
undetectable
4iqqA-2idvA:
18.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jbh PHOSPHORIBOSYLTRANSF
ERASE
DOMAIN-CONTAINING
PROTEIN 1


(Homo sapiens)
PF00156
(Pribosyltran)
4 TYR A 202
ILE A 215
GLY A 197
PHE A 206
None
0.65A 4iqqA-2jbhA:
undetectable
4iqqA-2jbhA:
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.
2k4j PUTATIVE
TRANSCRIPTIONAL
REGULATOR


(Helicobacter
pylori)
PF00486
(Trans_reg_C)
4 ILE A  23
LEU A 113
GLY A  58
TYR A 111
None
0.86A 4iqqA-2k4jA:
undetectable
4iqqA-2k4jA:
14.01
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.
2kxp F-ACTIN-CAPPING
PROTEIN SUBUNIT
ALPHA-1
F-ACTIN-CAPPING
PROTEIN SUBUNIT BETA
ISOFORMS 1 AND 2


(Gallus gallus)
PF01115
(F_actin_cap_B)
PF01267
(F-actin_cap_A)
4 TYR A 198
ILE B 531
LEU B 489
GLY B 490
None
0.89A 4iqqA-2kxpA:
undetectable
4iqqA-2kxpA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ntt STAPHYLOCOCCAL
ENTEROTOXIN K


(Staphylococcus
aureus)
PF02876
(Stap_Strp_tox_C)
4 TYR A 137
ILE A  99
LEU A 180
GLY A 164
None
None
None
EDO  A7009 (-4.7A)
0.93A 4iqqA-2nttA:
undetectable
4iqqA-2nttA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o1o PUTATIVE FARNESYL
PYROPHOSPHATE
SYNTHASE


(Cryptosporidium
parvum)
PF00348
(polyprenyl_synt)
4 ILE A 355
GLY A 247
PHE A 249
TYR A 214
None
0.79A 4iqqA-2o1oA:
undetectable
4iqqA-2o1oA:
19.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oip CHAIN A, CRYSTAL
STRUCTURE OF DHFR


(Cryptosporidium
hominis)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
5 ILE A 315
ASP A 426
LEU A 429
GLY A 430
TYR A 466
CB3  A 604 ( 3.7A)
CB3  A 604 ( 3.9A)
CB3  A 604 ( 4.4A)
CB3  A 604 ( 3.4A)
UMP  A 603 ( 4.3A)
0.77A 4iqqA-2oipA:
40.5
4iqqA-2oipA:
32.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oip CHAIN A, CRYSTAL
STRUCTURE OF DHFR


(Cryptosporidium
hominis)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
5 ILE A 315
LEU A 429
GLY A 430
PHE A 433
TYR A 466
CB3  A 604 ( 3.7A)
CB3  A 604 ( 4.4A)
CB3  A 604 ( 3.4A)
CB3  A 604 ( 3.9A)
UMP  A 603 ( 4.3A)
1.18A 4iqqA-2oipA:
40.5
4iqqA-2oipA:
32.05
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.
2p76 GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE


(Staphylococcus
aureus)
PF03009
(GDPD)
4 TYR A 166
ILE A 156
LEU A  90
TYR A 176
None
0.89A 4iqqA-2p76A:
undetectable
4iqqA-2p76A:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r26 CITRATE SYNTHASE

(Thermoplasma
acidophilum)
PF00285
(Citrate_synt)
4 ILE A 251
ASP A 301
GLY A 303
PHE A 307
None
None
None
CMC  A 701 ( 4.3A)
0.93A 4iqqA-2r26A:
undetectable
4iqqA-2r26A:
20.43
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.
2r26 CITRATE SYNTHASE

(Thermoplasma
acidophilum)
PF00285
(Citrate_synt)
4 TYR A 313
ASP A 317
GLY A 259
PHE A 260
None
CMC  A 701 (-2.7A)
CMC  A 701 (-3.3A)
None
0.82A 4iqqA-2r26A:
undetectable
4iqqA-2r26A:
20.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2tdd THYMIDYLATE SYNTHASE

(Lactobacillus
casei)
PF00303
(Thymidylat_synt)
5 ASP A 221
LEU A 224
GLY A 225
PHE A 228
TYR A 261
UFP  A 529 (-4.7A)
THF  A 568 (-3.6A)
UFP  A 529 ( 4.0A)
THF  A 568 (-4.8A)
UFP  A 529 (-4.7A)
0.98A 4iqqA-2tddA:
32.8
4iqqA-2tddA:
41.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2tdd THYMIDYLATE SYNTHASE

(Lactobacillus
casei)
PF00303
(Thymidylat_synt)
5 ILE A  81
ASP A 221
GLY A 225
PHE A 228
TYR A 261
THF  A 568 ( 4.8A)
UFP  A 529 (-4.7A)
UFP  A 529 ( 4.0A)
THF  A 568 (-4.8A)
UFP  A 529 (-4.7A)
1.22A 4iqqA-2tddA:
32.8
4iqqA-2tddA:
41.01
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.
2wed PENICILLOPEPSIN

(Penicillium
janthinellum)
PF00026
(Asp)
5 ASP A 300
LEU A 303
GLY A 299
PHE A 298
TYR A  17
None
1.24A 4iqqA-2wedA:
undetectable
4iqqA-2wedA:
22.91
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.
2wmc EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4E


(Pisum sativum)
PF01652
(IF4E)
4 ILE A 179
ASP A 161
GLY A 160
PHE A 157
None
0.67A 4iqqA-2wmcA:
undetectable
4iqqA-2wmcA:
17.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xxl GRAM-POSITIVE
SPECIFIC SERINE
PROTEASE, ISOFORM B


(Drosophila
melanogaster)
PF00089
(Trypsin)
PF12032
(CLIP)
4 ILE A 257
LEU A 322
GLY A 340
PHE A 339
None
0.91A 4iqqA-2xxlA:
undetectable
4iqqA-2xxlA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xy4 ZINC ABC
TRANSPORTER,
PERIPLASMIC
ZINC-BINDING PROTEIN


(Salmonella
enterica)
PF01297
(ZnuA)
4 TYR A 296
ILE A  38
ASP A  44
PHE A 184
None
0.90A 4iqqA-2xy4A:
undetectable
4iqqA-2xy4A:
22.22
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.
2y4o PHENYLACETATE-COENZY
ME A LIGASE


(Burkholderia
cenocepacia)
PF00501
(AMP-binding)
PF14535
(AMP-binding_C_2)
4 ILE A 240
GLY A 147
PHE A 140
TYR A 109
DLL  A1441 (-4.7A)
DLL  A1441 (-3.6A)
DLL  A1441 (-3.6A)
None
0.92A 4iqqA-2y4oA:
undetectable
4iqqA-2y4oA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yxx DIAMINOPIMELATE
DECARBOXYLASE


(Thermotoga
maritima)
PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N)
4 ILE A 173
ASP A 162
LEU A 161
PHE A 164
None
0.89A 4iqqA-2yxxA:
undetectable
4iqqA-2yxxA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a31 PROBABLE
THREONYL-TRNA
SYNTHETASE 1


(Aeropyrum
pernix)
PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
4 ILE A  18
LEU A 154
GLY A 322
TYR A 152
None
0.70A 4iqqA-3a31A:
undetectable
4iqqA-3a31A:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bo7 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
CYCLOPHILIN-TYPE


(Toxoplasma
gondii)
PF00160
(Pro_isomerase)
4 ILE A 121
ASP A 144
LEU A 143
GLY A 142
None
0.78A 4iqqA-3bo7A:
undetectable
4iqqA-3bo7A:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d0c DIHYDRODIPICOLINATE
SYNTHASE


(Oceanobacillus
iheyensis)
PF00701
(DHDPS)
4 TYR A 166
ILE A 152
GLY A 163
PHE A 189
None
0.87A 4iqqA-3d0cA:
undetectable
4iqqA-3d0cA:
21.91
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.
3d3s L-2,4-DIAMINOBUTYRIC
ACID
ACETYLTRANSFERASE


(Bordetella
parapertussis)
PF00583
(Acetyltransf_1)
5 TYR A  33
ASP A  55
LEU A  18
GLY A  56
PHE A  57
None
GOL  A 168 (-4.0A)
GOL  A 168 (-4.1A)
None
None
1.48A 4iqqA-3d3sA:
undetectable
4iqqA-3d3sA:
21.66
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.
3emy TRICHODERMA REESEI
ASPARTIC PROTEASE


(Trichoderma
reesei)
PF00026
(Asp)
5 ASP A 304
LEU A 307
GLY A 303
PHE A 302
TYR A  14
None
1.17A 4iqqA-3emyA:
undetectable
4iqqA-3emyA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3evr MYOSIN LIGHT CHAIN
KINASE, GREEN
FLUORESCENT PROTEIN,
CALMODULIN-1 CHIMERA


(Aequorea
victoria;
Rattus
norvegicus)
PF01353
(GFP)
PF13499
(EF-hand_7)
4 ILE A 256
ASP A 287
GLY A 262
PHE A 258
None
0.91A 4iqqA-3evrA:
undetectable
4iqqA-3evrA:
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.
3f0h AMINOTRANSFERASE

([Eubacterium]
rectale)
PF00266
(Aminotran_5)
4 TYR A 121
LEU A 129
GLY A 128
PHE A 126
GOL  A 361 (-4.1A)
None
None
None
0.80A 4iqqA-3f0hA:
undetectable
4iqqA-3f0hA:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gme POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE


(Escherichia
coli)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase)
4 ILE A 533
LEU A 448
GLY A 445
PHE A 343
None
0.92A 4iqqA-3gmeA:
undetectable
4iqqA-3gmeA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gve YFKN PROTEIN

(Bacillus
subtilis)
PF00149
(Metallophos)
4 TYR A 140
ILE A 119
ASP A  58
GLY A 101
None
0.85A 4iqqA-3gveA:
undetectable
4iqqA-3gveA:
22.79
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.
3heb RESPONSE REGULATOR
RECEIVER DOMAIN
PROTEIN (CHEY)


(Rhodospirillum
rubrum)
PF00072
(Response_reg)
4 ILE A  10
LEU A 135
GLY A 136
PHE A 139
None
0.68A 4iqqA-3hebA:
undetectable
4iqqA-3hebA:
19.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ix6 THYMIDYLATE SYNTHASE

(Brucella
melitensis)
PF00303
(Thymidylat_synt)
4 ASP A 169
LEU A 172
GLY A 173
TYR A 209
None
0.85A 4iqqA-3ix6A:
32.5
4iqqA-3ix6A:
38.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ix6 THYMIDYLATE SYNTHASE

(Brucella
melitensis)
PF00303
(Thymidylat_synt)
4 ILE A  79
ASP A 169
GLY A 173
TYR A 209
None
0.62A 4iqqA-3ix6A:
32.5
4iqqA-3ix6A:
38.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iyj MAJOR CAPSID PROTEIN
L1


(Deltapapillomavirus
4)
no annotation 4 ILE F  99
LEU F 461
GLY F 462
PHE F 465
None
0.82A 4iqqA-3iyjF:
undetectable
4iqqA-3iyjF:
19.96
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.
3jxz ALKYLPURINE DNA
GLYCOSYLASE ALKD


(Bacillus cereus)
PF08713
(DNA_alkylation)
5 ILE A 131
ASP A 122
LEU A 125
GLY A 121
PHE A 153
None
1.29A 4iqqA-3jxzA:
undetectable
4iqqA-3jxzA:
19.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kgb THYMIDYLATE SYNTHASE
1/2


(Encephalitozoon
cuniculi)
PF00303
(Thymidylat_synt)
4 LEU A 200
GLY A 201
PHE A 204
TYR A 237
None
0.72A 4iqqA-3kgbA:
36.5
4iqqA-3kgbA:
50.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kjr DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE


(Babesia bovis)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
4 ASP A 416
LEU A 419
GLY A 420
TYR A 456
None
0.72A 4iqqA-3kjrA:
40.0
4iqqA-3kjrA:
35.35
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.
3kq5 HYPOTHETICAL
CYTOSOLIC PROTEIN


(Coxiella
burnetii)
PF07515
(TraI_2_C)
4 ILE A 367
LEU A 320
GLY A 319
PHE A 318
None
0.72A 4iqqA-3kq5A:
undetectable
4iqqA-3kq5A:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nng UNCHARACTERIZED
PROTEIN


(Bacteroides
fragilis)
PF00754
(F5_F8_type_C)
4 ILE A 273
LEU A 251
GLY A 253
PHE A 254
None
0.93A 4iqqA-3nngA:
undetectable
4iqqA-3nngA:
16.04
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.
3o7t CYCLOPHILIN A

(Moniliophthora
perniciosa)
PF00160
(Pro_isomerase)
4 ILE A 112
ASP A 135
LEU A 134
GLY A 133
None
0.84A 4iqqA-3o7tA:
undetectable
4iqqA-3o7tA:
19.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ob8 BETA-GALACTOSIDASE

(Kluyveromyces
lactis)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
4 TYR A 890
ILE A 943
GLY A 949
PHE A 945
None
0.83A 4iqqA-3ob8A:
undetectable
4iqqA-3ob8A:
14.60
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.
3on4 TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY


(Legionella
pneumophila)
PF00440
(TetR_N)
4 TYR A  25
ILE A 120
LEU A 105
GLY A 106
None
0.82A 4iqqA-3on4A:
undetectable
4iqqA-3on4A:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3org CMCLC

(Cyanidioschyzon
merolae)
PF00654
(Voltage_CLC)
4 ILE A 436
LEU A 333
GLY A 334
PHE A 337
None
0.88A 4iqqA-3orgA:
undetectable
4iqqA-3orgA:
18.67
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.
3osr MALTOSE-BINDING
PERIPLASMIC
PROTEIN,GREEN
FLUORESCENT PROTEIN


(Aequorea
victoria;
Escherichia
coli)
PF01353
(GFP)
PF01547
(SBP_bac_1)
4 ILE A 510
ASP A 541
GLY A 516
PHE A 512
None
0.88A 4iqqA-3osrA:
undetectable
4iqqA-3osrA:
19.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p8c NCK-ASSOCIATED
PROTEIN 1


(Homo sapiens)
PF09735
(Nckap1)
4 TYR B  93
ILE B 156
ASP B 172
PHE B  97
None
0.90A 4iqqA-3p8cB:
undetectable
4iqqA-3p8cB:
14.57
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.
3qm3 FRUCTOSE-BISPHOSPHAT
E ALDOLASE


(Campylobacter
jejuni)
PF01116
(F_bP_aldolase)
4 TYR A  68
ILE A  42
ASP A 284
PHE A  60
None
0.80A 4iqqA-3qm3A:
undetectable
4iqqA-3qm3A:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qmj ENOYL-COA HYDRATASE,
ECHA8_6


(Mycobacterium
marinum)
PF00378
(ECH_1)
4 ILE A 112
LEU A 127
GLY A 105
PHE A  58
None
0.92A 4iqqA-3qmjA:
undetectable
4iqqA-3qmjA:
20.43