SIMILAR PATTERNS OF AMINO ACIDS FOR 4I41_A_MIXA501

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.
1aug PYROGLUTAMYL
PEPTIDASE-1


(Bacillus
amyloliquefaciens)
PF01470
(Peptidase_C15)
5 ILE A 207
THR A 209
ASP A 206
THR A 115
ILE A 122
None
1.35A 4i41A-1augA:
undetectable
4i41A-1augA:
23.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fdj FRUCTOSE
1,6-BISPHOSPHATE
ALDOLASE


(Oryctolagus
cuniculus)
PF00274
(Glycolytic)
5 THR A1122
VAL A1150
ASP A1193
ILE A1191
GLU A1187
None
None
None
None
2FP  A5001 (-4.3A)
1.30A 4i41A-1fdjA:
undetectable
4i41A-1fdjA:
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.
1fdw 17-BETA-HYDROXYSTERO
ID DEHYDROGENASE


(Homo sapiens)
PF00106
(adh_short)
5 ILE A   7
THR A   8
THR A 190
VAL A 188
ILE A  14
None
1.36A 4i41A-1fdwA:
undetectable
4i41A-1fdwA:
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.
1gcw PROTEIN (HEMOGLOBIN)

(Mustelus
griseus)
PF00042
(Globin)
5 ILE B 100
THR B  97
ILE B  11
GLU B   7
GLU B   6
None
HEM  B 136 ( 4.6A)
None
None
None
1.26A 4i41A-1gcwB:
undetectable
4i41A-1gcwB:
19.57
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.
1jpu GLYCEROL
DEHYDROGENASE


(Geobacillus
stearothermophilus)
PF00465
(Fe-ADH)
5 ILE A  45
THR A 240
VAL A 236
ILE A 159
GLU A 233
None
0.92A 4i41A-1jpuA:
undetectable
4i41A-1jpuA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kqg FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
IRON-SULFUR SUBUNIT


(Escherichia
coli)
PF09163
(Form-deh_trans)
PF12800
(Fer4_4)
PF13247
(Fer4_11)
5 ILE B   8
ASP B   7
VAL B 167
ASP B 127
ILE B 125
None
1.36A 4i41A-1kqgB:
undetectable
4i41A-1kqgB:
20.68
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.
1mhz METHANE
MONOOXYGENASE
HYDROXYLASE


(Methylosinus
trichosporium)
PF02332
(Phenol_Hydrox)
5 LYS D  74
ASP D  75
THR D 241
VAL D 239
GLU D 114
None
None
None
None
FE  D 801 ( 2.7A)
1.33A 4i41A-1mhzD:
undetectable
4i41A-1mhzD:
20.98
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.
1mr2 ADPR PYROPHOSPHATASE

(Mycobacterium
tuberculosis)
PF00293
(NUDIX)
5 ILE A 164
VAL A 122
ILE A 168
GLU A 120
ARG A  64
None
None
None
None
A12  A 301 (-2.5A)
1.37A 4i41A-1mr2A:
undetectable
4i41A-1mr2A:
24.50
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.
1s6j CALCIUM-DEPENDENT
PROTEIN KINASE SK5


(Glycine max)
PF13499
(EF-hand_7)
5 ILE A  40
THR A  41
LYS A  30
ASP A  33
ASP A  77
None
None
None
CA  A  88 (-3.0A)
CA  A  89 (-4.3A)
1.36A 4i41A-1s6jA:
undetectable
4i41A-1s6jA:
14.89
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.
1tzs CATHEPSIN E

(Homo sapiens)
PF00026
(Asp)
5 ILE A 234
THR A 235
VAL A 164
ASP A 319
ILE A 322
None
1.29A 4i41A-1tzsA:
undetectable
4i41A-1tzsA:
22.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vpv UPF0230 PROTEIN
TM1468


(Thermotoga
maritima)
PF02645
(DegV)
5 ILE A 125
VAL A 272
ASP A  12
ILE A 268
ARG A  42
None
None
None
PLM  A 501 ( 4.5A)
None
1.15A 4i41A-1vpvA:
undetectable
4i41A-1vpvA:
22.36
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.
1wzc MANNOSYL-3-PHOSPHOGL
YCERATE PHOSPHATASE


(Pyrococcus
horikoshii)
PF08282
(Hydrolase_3)
5 ILE A 235
THR A  12
THR A  58
VAL A  56
ILE A  26
None
MG  A 300 ( 4.9A)
None
None
None
1.39A 4i41A-1wzcA:
undetectable
4i41A-1wzcA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xrs D-LYSINE
5,6-AMINOMUTASE
ALPHA SUBUNIT


(Acetoanaerobium
sticklandii)
PF09043
(Lys-AminoMut_A)
5 ILE A  30
THR A  26
THR A 295
GLU A 321
GLU A 331
None
1.39A 4i41A-1xrsA:
undetectable
4i41A-1xrsA:
20.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xx7 OXETANOCIN-LIKE
PROTEIN


(Pyrococcus
furiosus)
PF13023
(HD_3)
5 ILE A  40
THR A  41
VAL A  30
ASP A 124
GLU A  71
None
None
None
NI  A 201 ( 2.6A)
None
1.26A 4i41A-1xx7A:
undetectable
4i41A-1xx7A:
18.66
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.
1ycg NITRIC OXIDE
REDUCTASE


(Moorella
thermoacetica)
PF00258
(Flavodoxin_1)
PF00753
(Lactamase_B)
5 THR A 155
VAL A 157
ASP A  44
ILE A  42
GLU A 159
None
1.34A 4i41A-1ycgA:
undetectable
4i41A-1ycgA:
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.
1zxx 6-PHOSPHOFRUCTOKINAS
E


(Lactobacillus
delbrueckii)
PF00365
(PFK)
5 ILE A 137
ASP A 260
THR A 145
ILE A 126
GLU A 222
None
1.34A 4i41A-1zxxA:
undetectable
4i41A-1zxxA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2avn UBIQUINONE/MENAQUINO
NE BIOSYNTHESIS
METHYLTRANSFERASE-RE
LATED PROTEIN


(Thermotoga
maritima)
PF08241
(Methyltransf_11)
5 THR A  53
THR A 139
ASP A  48
ASP A  71
GLU A  94
None
None
SAI  A1300 ( 4.9A)
SAI  A1300 (-2.9A)
SAI  A1300 (-3.0A)
1.23A 4i41A-2avnA:
undetectable
4i41A-2avnA:
23.67
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.
2b39 C3

(Bos taurus)
PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
5 ILE A 330
THR A1419
ASP A 752
ILE A 754
GLU A 757
None
1.27A 4i41A-2b39A:
undetectable
4i41A-2b39A:
10.58
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.
2cbn RIBONUCLEASE Z

(Escherichia
coli)
PF12706
(Lactamase_B_2)
5 ILE A  62
ASP A  38
THR A 269
VAL A 230
ILE A 209
None
1.40A 4i41A-2cbnA:
undetectable
4i41A-2cbnA:
24.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2een HYPOTHETICAL PROTEIN
PH1819


(Pyrococcus
horikoshii)
PF01928
(CYTH)
5 THR A 138
VAL A 140
ASP A  72
ILE A 146
GLU A 145
None
1.34A 4i41A-2eenA:
undetectable
4i41A-2eenA:
19.93
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.
2glx 1,5-ANHYDRO-D-FRUCTO
SE REDUCTASE


(Ensifer
adhaerens)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
5 ASP A 181
THR A 239
VAL A 153
ASP A 176
ILE A 177
None
None
None
ACT  A1502 ( 3.9A)
None
1.29A 4i41A-2glxA:
undetectable
4i41A-2glxA:
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.
2hd3 ETHANOLAMINE
UTILIZATION PROTEIN
EUTN


(Escherichia
coli)
PF03319
(EutN_CcmL)
5 ILE A  47
VAL A  74
ASP A  45
ASP A  22
ILE A  44
None
1.32A 4i41A-2hd3A:
undetectable
4i41A-2hd3A:
16.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i9e TRIOSEPHOSPHATE
ISOMERASE


(Tenebrio
molitor)
PF00121
(TIM)
5 ILE A 123
VAL A 142
ILE A 126
GLU A 128
GLU A 132
None
1.31A 4i41A-2i9eA:
undetectable
4i41A-2i9eA:
22.45
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.
2ibp CITRATE SYNTHASE

(Pyrobaculum
aerophilum)
PF00285
(Citrate_synt)
5 THR A  34
VAL A 291
ASP A  38
ILE A  39
GLU A  42
None
1.41A 4i41A-2ibpA:
1.8
4i41A-2ibpA:
23.09
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.
2im9 HYPOTHETICAL PROTEIN

(Legionella
pneumophila)
PF07313
(DUF1460)
5 ILE A 289
ASP A 288
ASP A 163
ILE A 162
GLU A 236
None
1.21A 4i41A-2im9A:
undetectable
4i41A-2im9A:
21.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2iwi SERINE/THREONINE-PRO
TEIN KINASE PIM-2


(Homo sapiens)
PF00069
(Pkinase)
9 ILE A 129
THR A 130
ASP A 166
THR A 200
VAL A 202
ASP A 230
ASP A 235
ILE A 236
GLU A 243
None
0.86A 4i41A-2iwiA:
36.6
4i41A-2iwiA:
55.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2iwi SERINE/THREONINE-PRO
TEIN KINASE PIM-2


(Homo sapiens)
PF00069
(Pkinase)
9 ILE A 129
THR A 130
ASP A 166
VAL A 202
ASP A 230
ASP A 235
ILE A 236
GLU A 239
GLU A 243
None
0.85A 4i41A-2iwiA:
36.6
4i41A-2iwiA:
55.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2iwi SERINE/THREONINE-PRO
TEIN KINASE PIM-2


(Homo sapiens)
PF00069
(Pkinase)
8 ILE A 129
THR A 130
LYS A 165
ASP A 166
ASP A 230
ASP A 235
ILE A 236
GLU A 239
None
0.80A 4i41A-2iwiA:
36.6
4i41A-2iwiA:
55.92
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.
2o8v PHOSPHOADENOSINE
PHOSPHOSULFATE
REDUCTASE


(Escherichia
coli)
PF01507
(PAPS_reduct)
5 ILE A 190
THR A 189
VAL A 169
ILE A 183
GLU A  29
None
1.33A 4i41A-2o8vA:
undetectable
4i41A-2o8vA:
22.33
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.
2pfk 6-PHOSPHOFRUCTOKINAS
E ISOZYME I


(Escherichia
coli)
PF00365
(PFK)
5 ILE A 137
ASP A 260
THR A 145
ILE A 126
GLU A 222
None
1.32A 4i41A-2pfkA:
undetectable
4i41A-2pfkA:
21.26
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.
2q49 PROBABLE
N-ACETYL-GAMMA-GLUTA
MYL-PHOSPHATE
REDUCTASE


(Arabidopsis
thaliana)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
5 ILE A 321
VAL A 240
ILE A 186
GLU A 184
ARG A 318
None
1.10A 4i41A-2q49A:
undetectable
4i41A-2q49A:
22.97
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.
2uwb CELLULASE

(Tropaeolum
majus)
PF00722
(Glyco_hydro_16)
PF06955
(XET_C)
5 ILE A  95
THR A 263
ASP A  93
ILE A 116
ARG A 171
None
1.29A 4i41A-2uwbA:
undetectable
4i41A-2uwbA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yoc PULLULANASE

(Klebsiella
oxytoca)
PF02922
(CBM_48)
PF03714
(PUD)
PF11852
(DUF3372)
5 THR A 967
ASP A 770
ASP A 787
ILE A 798
GLU A 797
None
1.29A 4i41A-2yocA:
undetectable
4i41A-2yocA:
15.03
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.
3a1j CELL CYCLE
CHECKPOINT PROTEIN
RAD1


(Homo sapiens)
PF02144
(Rad1)
5 ILE C  30
THR C  29
VAL C 241
GLU C 211
ARG C 258
None
1.36A 4i41A-3a1jC:
undetectable
4i41A-3a1jC:
19.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3au7 PUTATIVE
UNCHARACTERIZED
PROTEIN


(Archaeoglobus
fulgidus)
PF01336
(tRNA_anti-codon)
PF08489
(DUF1743)
5 THR A  48
ASP A 115
VAL A 258
ILE A 253
GLU A 256
None
1.32A 4i41A-3au7A:
undetectable
4i41A-3au7A:
21.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dls PAS
DOMAIN-CONTAINING
SERINE/THREONINE-PRO
TEIN KINASE


(Homo sapiens)
PF00069
(Pkinase)
5 ILE A1094
LYS A1130
ASP A1131
THR A1165
GLU A1205
None
0.88A 4i41A-3dlsA:
31.4
4i41A-3dlsA:
31.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3f2a PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE PIM-1


(Homo sapiens)
PF00069
(Pkinase)
12 ILE A 133
THR A 134
LYS A 169
ASP A 170
THR A 204
VAL A 206
ASP A 234
ASP A 239
ILE A 240
GLU A 243
GLU A 247
ARG A 256
None
0.59A 4i41A-3f2aA:
44.5
4i41A-3f2aA:
95.55
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.
3g4s 50S RIBOSOMAL
PROTEIN L6P


(Haloarcula
marismortui)
PF00347
(Ribosomal_L6)
5 ILE E 118
THR E 122
VAL E 166
ILE E 148
GLU E 149
None
1.31A 4i41A-3g4sE:
undetectable
4i41A-3g4sE:
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.
3g77 CYTOSINE DEAMINASE

(Escherichia
coli)
PF07969
(Amidohydro_3)
5 ILE A 218
ASP A 216
THR A 228
VAL A 194
GLU A 191
None
1.26A 4i41A-3g77A:
undetectable
4i41A-3g77A:
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.
3g8d BIOTIN CARBOXYLASE

(Escherichia
coli)
PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
5 ILE A 315
THR A 304
VAL A 328
ILE A 323
GLU A 326
None
1.42A 4i41A-3g8dA:
undetectable
4i41A-3g8dA:
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.
3j26 CAPSID PROTEIN V20

(Mimivirus-dependent
virus Sputnik)
no annotation 5 ILE A 257
THR A 256
THR A 191
VAL A 189
ASP A  96
None
1.39A 4i41A-3j26A:
undetectable
4i41A-3j26A:
16.99
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.
3j70 MONOCLONAL ANTIBODY
17B LIGHT CHAIN


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
5 ILE A  69
THR A  70
THR A 107
VAL A 109
ARG A  66
None
1.26A 4i41A-3j70A:
undetectable
4i41A-3j70A:
22.76
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.
3j9d OUTER CAPSID PROTEIN
VP2


(Bluetongue
virus)
PF00898
(Orbi_VP2)
5 ILE A 854
THR A 845
ASP A 856
ASP A  39
GLU A  45
None
1.39A 4i41A-3j9dA:
undetectable
4i41A-3j9dA:
14.92
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.
3ksd GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1


(Staphylococcus
aureus)
no annotation 5 THR Q 176
THR Q 129
VAL Q 220
ILE Q 217
GLU Q 223
None
1.33A 4i41A-3ksdQ:
2.5
4i41A-3ksdQ:
20.34
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.
3q4i PHOSPHOHYDROLASE
(MUTT/NUDIX FAMILY
PROTEIN)


(Bacillus cereus)
PF00293
(NUDIX)
PF12535
(Nudix_N)
5 ILE A 129
VAL A 108
ASP A  70
ILE A  71
GLU A 116
None
None
None
None
GD3  A 301 (-3.1A)
1.41A 4i41A-3q4iA:
undetectable
4i41A-3q4iA:
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.
3qpf PUTATIVE
UNCHARACTERIZED
PROTEIN


(Streptococcus
pneumoniae)
PF06824
(Glyco_hydro_125)
5 ILE A 329
THR A 325
ASP A 299
ILE A 363
GLU A 417
None
None
None
None
EDO  A 433 ( 4.4A)
1.36A 4i41A-3qpfA:
undetectable
4i41A-3qpfA:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wgk CELL DIVISION
PROTEIN FTSZ


(Staphylococcus
aureus)
PF00091
(Tubulin)
PF12327
(FtsZ_C)
5 ILE A  61
THR A 128
VAL A  99
ILE A  17
GLU A  39
None
1.16A 4i41A-3wgkA:
undetectable
4i41A-3wgkA:
20.30
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.
3ypi TRIOSEPHOSPHATE
ISOMERASE


(Saccharomyces
cerevisiae)
PF00121
(TIM)
5 ILE A 124
VAL A 143
ILE A 127
GLU A 129
GLU A 133
None
1.39A 4i41A-3ypiA:
undetectable
4i41A-3ypiA:
19.41
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.
3zyy IRON-SULFUR CLUSTER
BINDING PROTEIN


(Carboxydothermus
hydrogenoformans)
PF00111
(Fer2)
PF14574
(DUF4445)
5 ILE X 507
THR X 471
VAL X 472
ILE X 461
GLU X 426
None
1.19A 4i41A-3zyyX:
undetectable
4i41A-3zyyX:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a3s 6-PHOSPHOFRUCTOKINAS
E


(Bacillus
subtilis)
PF00365
(PFK)
5 ILE A 137
ASP A 260
THR A 145
ILE A 126
GLU A 222
None
1.30A 4i41A-4a3sA:
undetectable
4i41A-4a3sA:
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.
4cj0 ENDOGLUCANASE D

(Ruminiclostridium
thermocellum)
PF00759
(Glyco_hydro_9)
PF02927
(CelD_N)
5 ILE A 241
ASP A 246
ASP A 243
ILE A 234
GLU A 233
None
CA  A1577 (-3.0A)
CA  A1577 (-3.3A)
None
None
1.19A 4i41A-4cj0A:
undetectable
4i41A-4cj0A:
17.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ex9 ALNA

(Streptomyces
sp. CM020)
PF04227
(Indigoidine_A)
5 ILE A 110
THR A 109
THR A 288
ASP A 142
ILE A 126
None
None
None
5RP  A 402 (-3.0A)
None
1.34A 4i41A-4ex9A:
undetectable
4i41A-4ex9A:
23.03
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.
4f0b THIOL TRANSFERASE

(Phanerochaete
chrysosporium)
PF00043
(GST_C)
PF02798
(GST_N)
5 ILE A 172
VAL A 216
ASP A 180
ILE A 210
GLU A 211
None
1.38A 4i41A-4f0bA:
undetectable
4i41A-4f0bA:
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.
4fzi PROSTAGLANDIN F
SYNTHASE


(Trypanosoma
cruzi)
PF00248
(Aldo_ket_red)
5 THR A 186
VAL A 247
ASP A 224
ILE A 221
GLU A 243
None
1.30A 4i41A-4fziA:
undetectable
4i41A-4fziA:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g4i 4-O-METHYL-GLUCURONO
YL METHYLESTERASE


(Thermothelomyces
thermophila)
no annotation 5 ILE A  98
THR A 222
VAL A 226
ASP A 190
ILE A 189
None
1.35A 4i41A-4g4iA:
undetectable
4i41A-4g4iA:
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.
4hne PHOSPHATIDYLINOSITOL
4-KINASE TYPE
2-ALPHA


(Homo sapiens)
PF00454
(PI3_PI4_kinase)
5 ILE A 304
ASP A 301
VAL A 342
ASP A 200
ILE A 207
ILE  A 304 ( 0.6A)
ASP  A 301 ( 0.6A)
VAL  A 342 ( 0.5A)
ASP  A 200 ( 0.6A)
ILE  A 207 ( 0.6A)
1.36A 4i41A-4hneA:
6.5
4i41A-4hneA:
19.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i4i 6-PHOSPHOFRUCTOKINAS
E


(Geobacillus
stearothermophilus)
PF00365
(PFK)
5 ILE A 137
ASP A 260
THR A 145
ILE A 126
GLU A 222
None
1.30A 4i41A-4i4iA:
undetectable
4i41A-4i4iA:
24.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k5c LOOP DESIGNED
ANKYRIN REPEAT
PROTEIN NRAN1_G06_C


(Escherichia
coli)
PF12796
(Ank_2)
5 ILE A 142
VAL A  63
ILE A 109
GLU A  64
GLU A  61
None
1.30A 4i41A-4k5cA:
undetectable
4i41A-4k5cA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l7a UNCHARACTERIZED
PROTEIN


(Bacteroides
caccae)
PF15890
(Peptidase_Mx1)
5 ILE A 189
VAL A 243
ASP A 256
ILE A 255
GLU A 241
None
1.40A 4i41A-4l7aA:
undetectable
4i41A-4l7aA:
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.
4lfn GALACTOSE-6-PHOSPHAT
E ISOMERASE SUBUNIT
A
GALACTOSE-6-PHOSPHAT
E ISOMERASE SUBUNIT
B


(Lactobacillus
rhamnosus)
PF02502
(LacAB_rpiB)
5 ILE B  81
ASP B  76
VAL A  41
ASP B 142
ILE B 141
None
1.35A 4i41A-4lfnB:
undetectable
4i41A-4lfnB:
19.00
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.
4lry PTS-DEPENDENT
DIHYDROXYACETONE
KINASE OPERON
REGULATORY PROTEIN


(Escherichia
coli)
PF00989
(PAS)
5 ILE C  16
LYS C 129
THR C 170
VAL C 167
ASP C 133
None
1.01A 4i41A-4lryC:
undetectable
4i41A-4lryC:
22.54
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.
4pw0 ALPHA/BETA HYDROLASE
FOLD PROTEIN


(Chitinophaga
pinensis)
PF00561
(Abhydrolase_1)
5 ILE A  65
VAL A 270
ASP A  50
ILE A  53
GLU A 267
None
1.35A 4i41A-4pw0A:
undetectable
4i41A-4pw0A:
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.
4q73 PROLINE
DEHYDROGENASE


(Bradyrhizobium
diazoefficiens)
PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg)
5 ASP A 768
VAL A 940
ASP A 923
ILE A 926
ARG A 142
None
1.37A 4i41A-4q73A:
0.2
4i41A-4q73A:
14.88
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.
4xhg SIMILAR TO
UNIPROT|P29295
SACCHAROMYCES
CEREVISIAE YPL204W
HRR25


([Candida]
glabrata)
PF00069
(Pkinase)
5 ILE A 129
ASP A 195
ASP A 194
ILE A 125
GLU A 189
None
1.32A 4i41A-4xhgA:
21.4
4i41A-4xhgA:
22.72
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.
4ymx ABC-TYPE AMINO ACID
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT


(Caldanaerobacter
subterraneus)
PF00497
(SBP_bac_3)
5 ILE A 104
THR A  43
ASP A  66
THR A 195
ARG A 113
None
None
None
None
ARG  A 301 (-2.9A)
1.38A 4i41A-4ymxA:
undetectable
4i41A-4ymxA:
22.36
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.
4zwn MONOGLYCERIDE LIPASE

(Saccharomyces
cerevisiae)
PF12146
(Hydrolase_4)
5 ILE A 253
THR A 252
THR A 288
VAL A 291
ILE A 283
None
1.22A 4i41A-4zwnA:
undetectable
4i41A-4zwnA:
23.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE


(Vesicular
stomatitis
virus)
PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap)
5 THR A 504
ASP A 522
ASP A 519
GLU A 512
GLU A 515
None
1.40A 4i41A-5a22A:
undetectable
4i41A-5a22A:
8.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a6d DNA POLYMERASE
SLIDING CLAMP


(Thermococcus
gammatolerans)
PF00705
(PCNA_N)
PF02747
(PCNA_C)
5 ILE A 101
THR A 102
ILE A   5
GLU A  62
GLU A  64
None
1.30A 4i41A-5a6dA:
undetectable
4i41A-5a6dA:
24.09
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.
5aqa OFF7_DB04V3

(synthetic
construct)
PF00023
(Ank)
PF12796
(Ank_2)
PF13354
(Beta-lactamase2)
5 ILE A 161
VAL A  96
ILE A 128
GLU A  97
GLU A  94
None
1.33A 4i41A-5aqaA:
undetectable
4i41A-5aqaA:
21.55
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.
5cwe CYTOCHROME P450
HYDROXYLASE


(Streptomyces
avermitilis)
PF00067
(p450)
5 ASP A 132
THR A 243
VAL A 239
ASP A 135
GLU A 236
None
1.19A 4i41A-5cweA:
undetectable
4i41A-5cweA:
21.39
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.
5dj4 SESTRIN-2

(Homo sapiens)
PF04636
(PA26)
5 THR A 476
THR A 202
VAL A 199
ILE A 195
GLU A 358
None
1.30A 4i41A-5dj4A:
undetectable
4i41A-5dj4A:
20.30
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.
5eut PHOSPHATIDYLINOSITOL
4-KINASE TYPE
2-ALPHA,ENDOLYSIN,PH
OSPHATIDYLINOSITOL
4-KINASE TYPE
2-ALPHA


(Escherichia
virus T4;
Homo sapiens)
PF00454
(PI3_PI4_kinase)
PF00959
(Phage_lysozyme)
5 ILE A 304
ASP A 301
VAL A 342
ASP A 200
ILE A 207
None
1.36A 4i41A-5eutA:
6.5
4i41A-5eutA:
20.07
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.
5fwm HEAT SHOCK PROTEIN
HSP 90 BETA


(Homo sapiens)
PF00183
(HSP90)
PF02518
(HATPase_c)
5 ILE A 123
VAL A 360
ASP A  49
ILE A 126
GLU A  42
None
None
None
None
ATP  A1691 (-4.0A)
1.38A 4i41A-5fwmA:
undetectable
4i41A-5fwmA:
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.
5h76 DARPIN,IMMUNOGLOBULI
N G-BINDING PROTEIN
A


(Staphylococcus
aureus;
synthetic
construct)
PF02216
(B)
PF12796
(Ank_2)
5 ILE A 128
VAL A  63
ILE A  95
GLU A  64
GLU A  61
None
1.37A 4i41A-5h76A:
undetectable
4i41A-5h76A:
22.07
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.
5i6z SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER


(Homo sapiens)
PF00209
(SNF)
5 ILE A 432
THR A 480
VAL A 489
ILE A 179
GLU A 493
None
1.43A 4i41A-5i6zA:
undetectable
4i41A-5i6zA:
18.20
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.
5ihr PROBABLE
BETA-GALACTOSIDASE A


(Aspergillus
niger)
PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5)
5 ILE A 296
THR A 417
VAL A 429
ASP A 331
GLU A 490
None
1.41A 4i41A-5ihrA:
undetectable
4i41A-5ihrA:
14.30
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.
5j9g GLYCERALDEHYDE-3-P
DEHYDROGENASE


(Lactobacillus
acidophilus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
5 THR A 248
THR A 134
VAL A 225
ILE A 222
GLU A 228
None
1.34A 4i41A-5j9gA:
2.5
4i41A-5j9gA:
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.
5l8x TETRAHYDROMETHANOPTE
RIN
S-METHYLTRANSFERASE
SUBUNIT A


(Methanocaldococcus
jannaschii)
PF04208
(MtrA)
5 ILE A 149
THR A 146
VAL A  19
ASP A  43
ILE A  42
None
1.40A 4i41A-5l8xA:
undetectable
4i41A-5l8xA:
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.
5lc8 ARACHIDONATE
15-LIPOXYGENASE


(Pseudomonas
aeruginosa)
PF00305
(Lipoxygenase)
5 ILE A 113
THR A 109
THR A 567
ILE A 608
GLU A 373
ZPE  A 703 ( 4.6A)
ZPE  A 703 ( 4.4A)
None
ZPE  A 703 ( 4.9A)
ZPE  A 703 (-4.1A)
1.16A 4i41A-5lc8A:
undetectable
4i41A-5lc8A:
16.32
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.
5lfd ALLANTOIN RACEMASE

(Pseudomonas
fluorescens)
no annotation 5 ILE A  18
THR A  17
THR A 114
GLU A  45
GLU A  49
None
1.37A 4i41A-5lfdA:
undetectable
4i41A-5lfdA:
19.79
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.
5mak R7

(synthetic
construct)
no annotation 5 ILE A 161
VAL A  96
ILE A 128
GLU A  97
GLU A  94
None
1.20A 4i41A-5makA:
undetectable
4i41A-5makA:
23.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mak R7

(synthetic
construct)
no annotation 5 ILE A 298
VAL A 233
ILE A 265
GLU A 234
GLU A 231
None
1.28A 4i41A-5makA:
undetectable
4i41A-5makA:
23.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mbm DARPIN 8H6

(synthetic
construct)
no annotation 5 ILE C 160
VAL C  95
ILE C 127
GLU C  96
GLU C  93
None
1.33A 4i41A-5mbmC:
undetectable
4i41A-5mbmC:
15.30
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.
5mg3 PROTEIN TRANSLOCASE
SUBUNIT SECD
PROTEIN TRANSLOCASE
SUBUNIT SECF


(Escherichia
coli)
PF02355
(SecD_SecF)
PF07549
(Sec_GG)
PF13721
(SecD-TM1)
5 ILE D 575
THR D 572
ASP F  51
GLU F 132
GLU F  59
None
1.37A 4i41A-5mg3D:
undetectable
4i41A-5mg3D:
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.
5msw THIOESTER REDUCTASE
DOMAIN-CONTAINING
PROTEIN


(Segniliparus
rugosus)
PF00501
(AMP-binding)
PF00550
(PP-binding)
5 ILE A  77
THR A 232
ASP A 208
GLU A 215
ARG A  85
None
1.16A 4i41A-5mswA:
undetectable
4i41A-5mswA:
12.35
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.
5ol6 NUCLEIC ACID
BINDING, OB-FOLD,
TRNA/HELICASE-TYPE,D
NA-DIRECTED DNA
POLYMERASE


(Nostoc
punctiforme)
no annotation 5 THR A  48
VAL A  20
ASP A  17
ILE A  18
ARG A  92
None
1.23A 4i41A-5ol6A:
undetectable
4i41A-5ol6A:
20.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tur SERINE/THREONINE-PRO
TEIN KINASE PIM-1


(Homo sapiens)
no annotation 11 ILE A 133
THR A 134
LYS A 169
ASP A 170
THR A 204
VAL A 206
ASP A 234
ASP A 239
ILE A 240
GLU A 247
ARG A 256
None
0.43A 4i41A-5turA:
44.2
4i41A-5turA:
70.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tur SERINE/THREONINE-PRO
TEIN KINASE PIM-1


(Homo sapiens)
no annotation 5 LYS A 169
THR A 204
VAL A 206
GLU A 243
GLU A 247
None
0.94A 4i41A-5turA:
44.2
4i41A-5turA:
70.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B


(Homo sapiens;
Spodoptera
frugiperda)
no annotation 5 ILE A 319
THR A 315
THR A  73
VAL A  74
ILE A  88
None
1.21A 4i41A-5v54A:
2.7
4i41A-5v54A:
15.27
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.
5vf3 CAPSID VERTEX
PROTEIN GP24


(Escherichia
virus T4)
PF07068
(Gp23)
5 ILE a 210
ASP a 213
THR a 220
VAL a 221
ILE a 340
None
1.22A 4i41A-5vf3a:
undetectable
4i41A-5vf3a:
21.33
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.
5x18 CASEIN KINASE I
HOMOLOG 1


(Saccharomyces
cerevisiae)
PF00069
(Pkinase)
5 ILE A 189
ASP A 257
ASP A 256
ILE A 185
GLU A 251
None
1.28A 4i41A-5x18A:
22.9
4i41A-5x18A:
24.53
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.
5xyi 40S RIBOSOMAL
PROTEIN S4


(Trichomonas
vaginalis)
PF00900
(Ribosomal_S4e)
PF01479
(S4)
PF08071
(RS4NT)
PF16121
(40S_S4_C)
5 ILE E 228
THR E 220
VAL E 208
ASP E 179
ILE E 195
None
A  2 601 ( 4.5A)
None
None
None
1.36A 4i41A-5xyiE:
undetectable
4i41A-5xyiE:
23.61
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.
5yly NITRATE REDUCTASE

(Ulva prolifera)
no annotation 5 ILE A 679
VAL A 647
ILE A 697
GLU A 655
ARG A 659
None
None
None
None
FAD  A1001 (-3.8A)
1.10A 4i41A-5ylyA:
undetectable
4i41A-5ylyA:
14.08
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.
6c9k DARP14 - SUBUNIT A
WITH DARPIN


(synthetic
construct)
no annotation 5 ILE A 278
VAL A 213
ILE A 245
GLU A 214
GLU A 211
None
1.35A 4i41A-6c9kA:
undetectable
4i41A-6c9kA:
15.33
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.
6chj DIACYLGLYCEROL
O-ACYLTRANSFERASE


(Marinobacter
hydrocarbonoclasticus)
no annotation 5 ILE A 235
THR A 236
VAL A 401
ASP A 404
ILE A 426
None
1.25A 4i41A-6chjA:
undetectable
4i41A-6chjA:
15.47
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.
6f5e DD_D12_10_47

(synthetic
construct)
no annotation 5 ILE A 161
VAL A  96
ILE A 128
GLU A  97
GLU A  94
None
1.33A 4i41A-6f5eA:
undetectable
4i41A-6f5eA:
17.41
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.
6fm7 BETA-LACTAMASE

(Aeromonas
enteropelogenes)
no annotation 5 THR A  68
THR A 316
VAL A 210
ASP A 217
ARG A 169
None
1.39A 4i41A-6fm7A:
undetectable
4i41A-6fm7A:
13.72
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.
6g45 PUTATIVE MAJOR
CAPSID PROTEIN


(Cafeteriavirus-dependent
mavirus)
no annotation 5 ASP A 433
VAL A 327
ASP A 360
ILE A 444
GLU A 292
None
1.40A 4i41A-6g45A:
undetectable
4i41A-6g45A:
14.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6gii CYTOCHROME P450

(Tepidiphilus
thermophilus)
no annotation 5 ASP A 200
THR A 318
VAL A 314
ASP A 203
GLU A 311
None
1.17A 4i41A-6giiA:
undetectable
4i41A-6giiA:
12.59
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.
6req PROTEIN
(METHYLMALONYL-COA
MUTASE)


(Propionibacterium
freudenreichii)
PF01642
(MM_CoA_mutase)
5 ILE B  70
ASP B  68
ASP B 248
GLU B 330
ARG B 296
None
1.22A 4i41A-6reqB:
undetectable
4i41A-6reqB:
21.16