SIMILAR PATTERNS OF AMINO ACIDS FOR 4DTA_A_ADNA401

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.
1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN


(Homo sapiens)
PF01273
(LBP_BPI_CETP)
PF02886
(LBP_BPI_CETP_C)
5 LYS A 420
PRO A 426
ILE A 205
ILE A 199
ASP A 200
PC1  A 778 (-4.5A)
None
None
None
PC1  A 778 ( 4.6A)
1.31A 4dtaA-1bp1A:
undetectable
4dtaA-1bp1A:
19.74
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.
1cv8 STAPHOPAIN

(Staphylococcus
aureus)
PF05543
(Peptidase_C47)
5 ALA A  25
PRO A  81
ILE A  71
LEU A  83
ILE A 171
E64  A 176 ( 4.1A)
None
None
None
None
1.33A 4dtaA-1cv8A:
undetectable
4dtaA-1cv8A:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e1c METHYLMALONYL-COA
MUTASE ALPHA CHAIN


(Propionibacterium
freudenreichii)
PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
5 ALA A  41
ILE A 446
HIS A 423
ILE A 254
ASP A 253
None
1.08A 4dtaA-1e1cA:
undetectable
4dtaA-1e1cA:
17.88
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.
1ebd DIHYDROLIPOAMIDE
DEHYDROGENASE


(Geobacillus
stearothermophilus)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A 325
ILE A 312
LYS A 324
ILE A 145
ILE A 315
FAD  A 462 ( 3.7A)
None
None
None
None
1.19A 4dtaA-1ebdA:
undetectable
4dtaA-1ebdA:
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.
1pwe L-SERINE DEHYDRATASE

(Rattus
norvegicus)
PF00291
(PALP)
5 ALA A 315
PRO A 268
ILE A 255
LEU A 265
ILE A 308
None
1.08A 4dtaA-1pweA:
undetectable
4dtaA-1pweA:
19.15
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.
1rj7 ECTODYSPLASIN A

(Homo sapiens)
PF00229
(TNF)
5 ALA A 318
ILE A 369
ILE A 260
LEU A 271
ILE A 371
None
1.20A 4dtaA-1rj7A:
undetectable
4dtaA-1rj7A:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rlm PHOSPHATASE

(Escherichia
coli)
PF08282
(Hydrolase_3)
5 ALA A 236
PRO A 159
ILE A 162
ILE A 158
ASP A 155
None
1.15A 4dtaA-1rlmA:
2.1
4dtaA-1rlmA:
22.05
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.
1s4d UROPORPHYRIN-III
C-METHYLTRANSFERASE


(Pseudomonas
denitrificans
(nomen
rejiciendum))
PF00590
(TP_methylase)
5 ALA A 191
ILE A 173
LEU A 155
ILE A 168
ASP A 166
None
0.97A 4dtaA-1s4dA:
undetectable
4dtaA-1s4dA:
20.57
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.
1un9 DIHYDROXYACETONE
KINASE


(Citrobacter
freundii)
PF02733
(Dak1)
PF02734
(Dak2)
5 ALA A 153
ILE A 156
PRO A 328
LEU A 318
ILE A 289
None
1.04A 4dtaA-1un9A:
undetectable
4dtaA-1un9A:
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.
1vjq DESIGNED PROTEIN

(-)
PF02244
(Propep_M14)
5 ALA A  21
PRO A   8
ILE A  62
LEU A  57
ILE A   6
None
1.01A 4dtaA-1vjqA:
undetectable
4dtaA-1vjqA:
15.36
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.
1yad REGULATORY PROTEIN
TENI


(Bacillus
subtilis)
PF02581
(TMP-TENI)
5 PRO A  85
ILE A  88
HIS A  96
LEU A  95
ASP A 116
None
1.26A 4dtaA-1yadA:
undetectable
4dtaA-1yadA:
21.36
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.
1zao RIO2 SERINE KINASE

(Archaeoglobus
fulgidus)
PF01163
(RIO1)
PF09202
(Rio2_N)
5 LYS A 120
PRO A 167
ILE A 182
LEU A 225
ILE A 234
ATP  A 286 (-2.6A)
ATP  A 286 ( 4.7A)
ATP  A 286 (-4.2A)
None
ATP  A 286 (-4.5A)
0.93A 4dtaA-1zaoA:
10.6
4dtaA-1zaoA:
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.
2e7j SEP-TRNA:CYS-TRNA
SYNTHASE


(Archaeoglobus
fulgidus)
PF05889
(SepSecS)
5 ALA A  81
ILE A 254
HIS A 208
LEU A 257
ILE A 217
None
None
PLP  A1209 (-3.5A)
None
None
1.10A 4dtaA-2e7jA:
undetectable
4dtaA-2e7jA:
22.39
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.
2gx8 NIF3-RELATED PROTEIN

(Bacillus cereus)
PF01784
(NIF3)
5 ALA A  57
ILE A  97
ILE A  33
LEU A  71
ILE A  99
None
1.24A 4dtaA-2gx8A:
undetectable
4dtaA-2gx8A:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hrz NUCLEOSIDE-DIPHOSPHA
TE-SUGAR EPIMERASE


(Agrobacterium
fabrum)
PF01370
(Epimerase)
5 ALA A  79
PRO A 128
ILE A 117
LEU A 113
ILE A  84
None
1.18A 4dtaA-2hrzA:
undetectable
4dtaA-2hrzA:
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.
2izo FLAP
STRUCTURE-SPECIFIC
ENDONUCLEASE


(Sulfolobus
solfataricus)
PF00752
(XPG_N)
PF00867
(XPG_I)
5 ILE A  71
LYS A 334
PRO A 142
ILE A  73
ASP A 295
None
1.27A 4dtaA-2izoA:
undetectable
4dtaA-2izoA:
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.
2k75 UNCHARACTERIZED
PROTEIN TA0387


(Thermoplasma
acidophilum)
no annotation 5 ALA A  71
ILE A  68
ILE A  22
LEU A  60
ILE A  53
None
1.29A 4dtaA-2k75A:
undetectable
4dtaA-2k75A:
16.83
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.
2q1d 2-KETO-3-DEOXY-D-ARA
BINONATE DEHYDRATASE


(Sulfolobus
solfataricus)
PF01557
(FAA_hydrolase)
5 ALA X 147
ILE X 251
PRO X  70
LEU X  34
ILE X 194
None
1.15A 4dtaA-2q1dX:
undetectable
4dtaA-2q1dX:
21.86
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.
2q83 YTAA PROTEIN

(Bacillus
subtilis)
PF01636
(APH)
5 LYS A  72
PRO A  99
ILE A 124
LEU A 246
ILE A 256
None
ADN  A   1 ( 4.9A)
ADN  A   1 (-4.6A)
None
ADN  A   1 ( 4.6A)
0.79A 4dtaA-2q83A:
15.2
4dtaA-2q83A:
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.
2qip PROTEIN OF UNKNOWN
FUNCTION VPA0982


(Vibrio
parahaemolyticus)
PF01936
(NYN)
5 ALA A  10
ILE A 102
ILE A 100
LEU A 121
ILE A 125
None
1.04A 4dtaA-2qipA:
undetectable
4dtaA-2qipA:
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.
2r9q 2'-DEOXYCYTIDINE
5'-TRIPHOSPHATE
DEAMINASE


(Agrobacterium
fabrum)
PF06559
(DCD)
5 ALA A  85
PRO A 151
ILE A 122
LEU A 164
ILE A 149
None
1.09A 4dtaA-2r9qA:
undetectable
4dtaA-2r9qA:
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.
2vsv RHOPHILIN-2

(Homo sapiens)
no annotation 5 ALA A 550
ILE A 517
ILE A 561
LEU A 578
ILE A 586
None
1.04A 4dtaA-2vsvA:
undetectable
4dtaA-2vsvA:
16.36
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.
2vwb PUTATIVE
O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE


(Methanocaldococcus
jannaschii)
PF00814
(Peptidase_M22)
PF01163
(RIO1)
5 ILE A 358
LYS A 360
PRO A 399
ILE A 416
ILE A 466
None
0.93A 4dtaA-2vwbA:
3.0
4dtaA-2vwbA:
21.27
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.
2x58 PEROXISOMAL
BIFUNCTIONAL ENZYME


(Rattus
norvegicus)
PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N)
5 ALA A 666
ILE A 627
LEU A 634
ILE A 645
ASP A 646
None
1.25A 4dtaA-2x58A:
undetectable
4dtaA-2x58A:
18.05
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.
2x58 PEROXISOMAL
BIFUNCTIONAL ENZYME


(Rattus
norvegicus)
PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N)
5 ALA A 666
ILE A 633
LEU A 634
ILE A 645
ASP A 646
None
1.29A 4dtaA-2x58A:
undetectable
4dtaA-2x58A:
18.05
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.
2yhm NUCLEOPROTEIN

(Human
orthopneumovirus)
PF03246
(Pneumo_ncap)
5 ALA A 206
ILE A 163
ILE A 159
LEU A  52
ILE A 160
None
1.27A 4dtaA-2yhmA:
undetectable
4dtaA-2yhmA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z2x TK-SUBTILISIN

(Thermococcus
kodakarensis)
PF00082
(Peptidase_S8)
5 ALA A 227
ILE A 204
ILE A 200
LEU A 114
ILE A 231
CA  A1006 (-4.9A)
None
None
None
None
1.25A 4dtaA-2z2xA:
undetectable
4dtaA-2z2xA:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bed PTS SYSTEM, IIA
COMPONENT


(Enterococcus
faecalis)
PF03610
(EIIA-man)
5 ALA A  14
ILE A  33
ILE A  52
LEU A  49
ILE A   6
None
1.18A 4dtaA-3bedA:
undetectable
4dtaA-3bedA:
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.
3bws PROTEIN LP49

(Leptospira
interrogans)
PF10282
(Lactonase)
5 ILE A 239
PRO A 279
ILE A 293
LEU A 291
ILE A 259
None
1.02A 4dtaA-3bwsA:
2.3
4dtaA-3bwsA:
21.77
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.
3cg1 UPF0100 PROTEIN
PF0080


(Pyrococcus
furiosus)
PF13531
(SBP_bac_11)
5 ALA A 201
ILE A 192
ILE A 212
ILE A 214
ASP A 156
None
1.30A 4dtaA-3cg1A:
undetectable
4dtaA-3cg1A:
22.29
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.
3dg7 MUCONATE
CYCLOISOMERASE


(Mycolicibacterium
smegmatis)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 ALA A 302
ILE A 353
ILE A 355
HIS A  31
LEU A  33
None
1.20A 4dtaA-3dg7A:
undetectable
4dtaA-3dg7A:
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.
3dm9 SIGNAL RECOGNITION
PARTICLE RECEPTOR


(Pyrococcus
furiosus)
PF00448
(SRP54)
PF02881
(SRP54_N)
5 ALA B 194
ILE B 211
ILE B 140
LEU B 170
ILE B 156
None
1.24A 4dtaA-3dm9B:
2.0
4dtaA-3dm9B:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dmy PROTEIN FDRA

(Escherichia
coli)
PF00549
(Ligase_CoA)
PF02629
(CoA_binding)
5 ALA A 111
ILE A 514
ILE A 123
LEU A 133
ILE A 516
None
1.17A 4dtaA-3dmyA:
undetectable
4dtaA-3dmyA:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dxi PUTATIVE ALDOLASE

(Bacteroides
vulgatus)
PF00682
(HMGL-like)
5 ALA A 114
ILE A 104
ILE A 102
LEU A  92
ILE A 121
None
1.20A 4dtaA-3dxiA:
undetectable
4dtaA-3dxiA:
24.31
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.
3e05 PRECORRIN-6Y
C5,15-METHYLTRANSFER
ASE
(DECARBOXYLATING)


(Geobacter
metallireducens)
no annotation 5 ALA A 400
ILE A 346
ILE A 332
LEU A 329
ILE A 333
None
1.15A 4dtaA-3e05A:
undetectable
4dtaA-3e05A:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e18 OXIDOREDUCTASE

(Listeria
innocua)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
5 ALA A 335
ILE A 336
ILE A 224
LEU A 183
ILE A 214
None
1.16A 4dtaA-3e18A:
undetectable
4dtaA-3e18A:
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.
3e7o MITOGEN-ACTIVATED
PROTEIN KINASE 9


(Homo sapiens)
PF00069
(Pkinase)
5 ALA A 113
PRO A 154
ILE A 214
LEU A 218
ILE A 119
35F  A   1 (-4.9A)
None
None
None
None
1.31A 4dtaA-3e7oA:
8.1
4dtaA-3e7oA:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f7w PUTATIVE
FRUCTOSAMINE-3-KINAS
E


(Thermobifida
fusca)
PF03881
(Fructosamin_kin)
5 LYS A  44
PRO A  76
LEU A 200
ILE A 209
ASP A 210
EDO  A 293 (-3.0A)
None
None
UNL  A 288 (-3.6A)
None
0.78A 4dtaA-3f7wA:
16.6
4dtaA-3f7wA:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gdo UNCHARACTERIZED
OXIDOREDUCTASE YVAA


(Bacillus
subtilis)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
5 ALA A 110
ILE A 338
ILE A 191
LEU A 195
ILE A 340
None
1.19A 4dtaA-3gdoA:
undetectable
4dtaA-3gdoA:
25.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ham AMINOGLYCOSIDE
PHOSPHOTRANSFERASE


(Enterococcus
faecium)
PF01636
(APH)
5 LYS A  42
PRO A  73
ILE A  88
ILE A 209
ASP A 210
None
0.74A 4dtaA-3hamA:
21.3
4dtaA-3hamA:
34.83
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.
3hjg PUTATIVE
ALPHA-RIBAZOLE-5'-PH
OSPHATE PHOSPHATASE
COBC


(Vibrio
parahaemolyticus)
PF00300
(His_Phos_1)
5 ILE A 135
ILE A 154
HIS A 181
LEU A   8
ILE A 182
None
1.30A 4dtaA-3hjgA:
undetectable
4dtaA-3hjgA:
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.
3hpf MUCONATE
CYCLOISOMERASE


(Oceanobacillus
iheyensis)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 ALA A 305
ILE A  25
LEU A 359
ILE A  37
ASP A 106
None
1.30A 4dtaA-3hpfA:
undetectable
4dtaA-3hpfA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k2k PUTATIVE
CARBOXYPEPTIDASE


(Burkholderia
mallei)
PF00246
(Peptidase_M14)
5 ALA A 132
PRO A 213
ILE A 181
LEU A 184
ILE A 211
None
1.20A 4dtaA-3k2kA:
undetectable
4dtaA-3k2kA:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kmi PUTATIVE MEMBRANE
PROTEIN COG4129


(Clostridioides
difficile)
PF11728
(ArAE_1_C)
5 ALA A 245
ILE A 172
ILE A 168
LEU A 231
ILE A 252
None
1.31A 4dtaA-3kmiA:
undetectable
4dtaA-3kmiA:
19.68
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.
3kom TRANSKETOLASE

(Francisella
tularensis)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
5 ILE A 537
ILE A 345
LEU A 349
ILE A 498
ASP A 496
None
1.28A 4dtaA-3komA:
undetectable
4dtaA-3komA:
19.16
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.
3ldg PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.472


(Streptococcus
mutans)
PF01170
(UPF0020)
PF02926
(THUMP)
5 ALA A 118
ILE A 114
ILE A 111
LEU A 148
ILE A 146
None
1.16A 4dtaA-3ldgA:
undetectable
4dtaA-3ldgA:
22.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n4t APH(2'')-ID

(Enterococcus
casseliflavus)
PF01636
(APH)
10 ALA A  36
ILE A  44
LYS A  46
PRO A  76
LYS A  97
ILE A  98
HIS A 202
LEU A 204
ILE A 216
ASP A 217
None
0.42A 4dtaA-3n4tA:
43.0
4dtaA-3n4tA:
99.67
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.
3on4 TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY


(Legionella
pneumophila)
PF00440
(TetR_N)
5 ALA A  91
ILE A  92
ILE A 157
LEU A 135
ILE A 131
None
1.27A 4dtaA-3on4A:
undetectable
4dtaA-3on4A:
19.74
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.
3ory FLAP ENDONUCLEASE 1

(Desulfurococcus
amylolyticus)
PF00752
(XPG_N)
PF00867
(XPG_I)
5 ALA A  35
PRO A  79
ILE A  77
LEU A  20
ILE A  72
None
1.20A 4dtaA-3oryA:
undetectable
4dtaA-3oryA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s4w FANCONI ANEMIA GROUP
D2 PROTEIN HOMOLOG


(Mus musculus)
PF14631
(FancD2)
5 ALA B 201
PRO B 242
ILE B 243
LEU B 229
ILE B 210
None
1.19A 4dtaA-3s4wB:
2.1
4dtaA-3s4wB:
11.74
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.
3t57 UDP-N-ACETYLGLUCOSAM
INE
O-ACYLTRANSFERASE
DOMAIN-CONTAINING
PROTEIN


(Arabidopsis
thaliana)
PF00132
(Hexapep)
PF13720
(Acetyltransf_11)
5 ILE A 184
ILE A 142
HIS A 155
LEU A 140
ILE A 154
None
1.31A 4dtaA-3t57A:
undetectable
4dtaA-3t57A:
19.72
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.
3tdw GENTAMICIN
RESISTANCE PROTEIN


(Enterococcus
gallinarum)
PF01636
(APH)
6 ALA A  35
PRO A  75
LYS A  94
HIS A 201
LEU A 203
ILE A 217
GDP  A 500 (-3.6A)
None
GDP  A 500 (-4.3A)
MG  A 501 ( 3.4A)
None
GDP  A 500 ( 4.1A)
0.65A 4dtaA-3tdwA:
29.7
4dtaA-3tdwA:
29.75
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.
3tny YFIY (ABC TRANSPORT
SYSTEM
SUBSTRATE-BINDING
PROTEIN)


(Bacillus cereus)
PF01497
(Peripla_BP_2)
5 ALA A  43
PRO A  82
ILE A 102
LEU A  99
ILE A  85
None
1.29A 4dtaA-3tnyA:
undetectable
4dtaA-3tnyA:
24.34
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.
3u0f BETA-KETOACYL
SYNTHASE


(Brucella
abortus)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
5 ILE A 314
PRO A 322
ILE A 293
LEU A 387
ILE A 290
None
1.28A 4dtaA-3u0fA:
undetectable
4dtaA-3u0fA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vgf MALTO-OLIGOSYLTREHAL
OSE TREHALOHYDROLASE


(Sulfolobus
solfataricus)
PF00128
(Alpha-amylase)
PF09071
(Alpha-amyl_C)
5 LYS A 231
ILE A 233
HIS A 264
ILE A 265
ASP A 259
None
1.26A 4dtaA-3vgfA:
2.4
4dtaA-3vgfA:
20.47
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.
4a05 CELLOBIOHYDROLASE
FAMILY 6


(Chaetomium
thermophilum)
PF01341
(Glyco_hydro_6)
5 ALA A 331
ILE A 378
PRO A 120
LEU A 126
ILE A 246
None
1.24A 4dtaA-4a05A:
undetectable
4dtaA-4a05A:
18.59
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.
4bc7 ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE,
PEROXISOMAL


(Cavia porcellus)
PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C)
5 PRO A 415
ILE A 408
HIS A 419
LEU A 405
ILE A 418
None
1.25A 4dtaA-4bc7A:
undetectable
4dtaA-4bc7A:
16.74
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.
4c3s ALDEHYDE
DEHYDROGENASE


(Lachnoclostridium
phytofermentans)
PF00171
(Aldedh)
5 ILE A 148
ILE A 176
HIS A  95
LEU A 175
ILE A 144
None
1.28A 4dtaA-4c3sA:
undetectable
4dtaA-4c3sA:
21.68
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.
4da5 CHOLINE KINASE ALPHA

(Homo sapiens)
PF01633
(Choline_kinase)
5 PRO A 194
ILE A 209
LEU A 313
ILE A 329
ASP A 330
None
1.04A 4dtaA-4da5A:
5.3
4dtaA-4da5A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fl0 AMINOTRANSFERASE
ALD1


(Arabidopsis
thaliana)
PF00155
(Aminotran_1_2)
5 ILE A 345
PRO A  85
ILE A  84
HIS A  91
ILE A  88
None
1.16A 4dtaA-4fl0A:
undetectable
4dtaA-4fl0A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fmw RNA
(GUANINE-9-)-METHYLT
RANSFERASE
DOMAIN-CONTAINING
PROTEIN 2


(Homo sapiens)
PF01746
(tRNA_m1G_MT)
5 ALA A 130
ILE A 105
HIS A 122
LEU A 143
ILE A 125
None
1.10A 4dtaA-4fmwA:
undetectable
4dtaA-4fmwA:
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.
4gfj TOPOISOMERASE V

(Methanopyrus
kandleri)
PF13412
(HTH_24)
PF14520
(HHH_5)
5 ALA A 581
ILE A 568
ILE A 565
LEU A 552
ILE A 562
None
1.24A 4dtaA-4gfjA:
2.2
4dtaA-4gfjA:
16.93
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.
4gvl TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens)
PF02080
(TrkA_C)
PF02254
(TrkA_N)
5 ALA A 506
PRO A 533
ILE A 521
LEU A 545
ILE A 518
None
1.19A 4dtaA-4gvlA:
undetectable
4dtaA-4gvlA:
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.
4h27 L-SERINE
DEHYDRATASE/L-THREON
INE DEAMINASE


(Homo sapiens)
PF00291
(PALP)
5 ALA A 315
PRO A 268
ILE A 255
LEU A 265
ILE A 308
None
1.11A 4dtaA-4h27A:
undetectable
4dtaA-4h27A:
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.
4kws D-MANNONATE
DEHYDRATASE


(Chromohalobacter
salexigens)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 ALA A 223
ILE A 253
ILE A 282
LEU A 276
ILE A 263
None
1.29A 4dtaA-4kwsA:
undetectable
4dtaA-4kwsA:
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.
4lqz UNCHARACTERIZED
PROTEIN


(Staphylococcus
aureus)
PF16253
(DUF4909)
5 ALA A  65
ILE A  83
ILE A  38
LEU A 154
ILE A  48
None
1.12A 4dtaA-4lqzA:
undetectable
4dtaA-4lqzA:
19.47
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.
4na3 POLYKETIDE SYNTHASE
PKSJ


(Bacillus
subtilis)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
5 ALA A 200
ILE A 183
ILE A 442
LEU A 374
ILE A   9
None
1.08A 4dtaA-4na3A:
undetectable
4dtaA-4na3A:
18.91
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.
4tr6 DNA POLYMERASE III
SUBUNIT BETA


(Bacillus
subtilis)
PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3)
5 ALA A 320
ILE A 266
ILE A 362
LEU A 341
ILE A 349
None
1.07A 4dtaA-4tr6A:
undetectable
4dtaA-4tr6A:
24.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xkz VALINE-TRNA LIGASE

(Pseudomonas
aeruginosa)
PF08264
(Anticodon_1)
5 ALA A 867
ILE A 809
ILE A 821
LEU A 849
ILE A 823
None
1.21A 4dtaA-4xkzA:
undetectable
4dtaA-4xkzA:
20.06
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.
4xt1 G-PROTEIN COUPLED
RECEPTOR HOMOLOG
US28
NANOBODY 7


(Cytomegalovirus;
Vicugna pacos)
PF00001
(7tm_1)
PF07686
(V-set)
5 ALA A 132
ILE A 133
ILE A 226
LEU A 230
ILE C 101
None
1.31A 4dtaA-4xt1A:
undetectable
4dtaA-4xt1A:
18.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yg7 SERINE/THREONINE-PRO
TEIN KINASE HIPA


(Escherichia
coli)
PF07804
(HipA_C)
PF13657
(Couple_hipA)
5 ALA D 421
ILE D 366
HIS D 346
LEU D 350
ILE D 347
None
1.24A 4dtaA-4yg7D:
5.1
4dtaA-4yg7D:
21.06
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.
4ykn PHOSPHATIDYLINOSITOL
3-KINASE REGULATORY
SUBUNIT
ALPHA,PHOSPHATIDYLIN
OSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT ALPHA
ISOFORM FUSION
PROTEIN


(Homo sapiens)
PF00017
(SH2)
PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd)
PF02192
(PI3K_p85B)
PF16454
(PI3K_P85_iSH2)
5 ILE A1816
ILE A1910
HIS A1994
LEU A2026
ILE A1991
None
1.24A 4dtaA-4yknA:
2.8
4dtaA-4yknA:
11.90
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.
4z37 PUTATIVE MIXED
POLYKETIDE
SYNTHASE/NON-RIBOSOM
AL PEPTIDE
SYNTHETASE


(Brevibacillus
brevis)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
5 ALA A2520
ILE A2503
ILE A2756
LEU A2685
ILE A2325
None
1.08A 4dtaA-4z37A:
undetectable
4dtaA-4z37A:
18.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ck7 ADP-DEPENDENT
GLUCOKINASE


(Mus musculus)
PF04587
(ADP_PFK_GK)
5 ILE A 357
ILE A 378
HIS A 365
LEU A 321
ILE A 361
None
1.13A 4dtaA-5ck7A:
undetectable
4dtaA-5ck7A:
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.
5e7s LON PROTEASE

(Meiothermus
taiwanensis)
PF05362
(Lon_C)
5 ALA A 502
ILE A 527
ILE A 574
LEU A 578
ILE A 550
None
1.07A 4dtaA-5e7sA:
undetectable
4dtaA-5e7sA:
22.52
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.
5erb POLYKETIDE SYNTHASE

(Bacillus
amyloliquefaciens)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
5 ALA A 207
ILE A 190
ILE A 443
LEU A 372
ILE A  11
None
1.10A 4dtaA-5erbA:
undetectable
4dtaA-5erbA:
17.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fi5 TETRAHYDROALSTONINE
SYNTHASE


(Catharanthus
roseus)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
5 ALA A 195
ILE A 185
ILE A 209
LEU A 260
ILE A 247
None
1.27A 4dtaA-5fi5A:
undetectable
4dtaA-5fi5A:
18.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gus HELIX-TURN-HELIX
DOMAIN-CONTAINING
PROTEIN


(Zymomonas
mobilis)
PF04266
(ASCH)
5 ALA A  10
ILE A  44
ILE A  22
LEU A  14
ILE A  46
None
1.21A 4dtaA-5gusA:
undetectable
4dtaA-5gusA:
17.82
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.
5gxd AMP-DEPENDENT
SYNTHETASE AND
LIGASE


(Dinoroseobacter
shibae)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N)
5 ALA A 155
PRO A 190
ILE A 183
LEU A 179
ILE A 160
None
1.27A 4dtaA-5gxdA:
undetectable
4dtaA-5gxdA:
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.
5izt OUTER SURFACE
PROTEIN


(Borreliella
burgdorferi)
PF05714
(Borrelia_lipo_1)
5 ALA A 232
ILE A 298
ILE A 388
LEU A 368
ILE A 284
None
1.19A 4dtaA-5iztA:
undetectable
4dtaA-5iztA:
21.38
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.
5jd8 PERIPLASMIC SERINE
PEPTIDASE DEGS


(Yersinia pestis)
PF13180
(PDZ_2)
PF13365
(Trypsin_2)
5 ILE A 258
ILE A 303
HIS A 298
LEU A 334
ILE A 297
None
1.24A 4dtaA-5jd8A:
undetectable
4dtaA-5jd8A:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n8p S-LAYER PROTEIN

(Caulobacter
vibrioides)
PF00353
(HemolysinCabind)
5 ALA A 924
ILE A 921
ILE A 909
LEU A 932
ILE A1005
None
1.31A 4dtaA-5n8pA:
undetectable
4dtaA-5n8pA:
11.55
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.
5n97 S-LAYER PROTEIN RSAA

(Caulobacter
vibrioides)
PF00353
(HemolysinCabind)
5 ALA A 924
ILE A 921
ILE A 909
LEU A 932
ILE A1005
None
1.31A 4dtaA-5n97A:
undetectable
4dtaA-5n97A:
14.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nhs BIFUNCTIONAL PROTEIN
FOLD


(Xanthomonas
albilineans)
no annotation 5 ALA A  34
PRO A  43
ILE A  72
ILE A 287
ASP A 291
None
1.20A 4dtaA-5nhsA:
undetectable
4dtaA-5nhsA:
14.19
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.
5njf METALLOPROTEASE PMBA

(Escherichia
coli)
PF01523
(PmbA_TldD)
5 ALA B 263
ILE B 264
ILE B 319
LEU B 285
ILE B 284
None
1.18A 4dtaA-5njfB:
undetectable
4dtaA-5njfB:
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.
5tv2 ELONGATION FACTOR G

(Vibrio
vulnificus)
PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
5 ALA A 281
ILE A 248
LEU A 222
ILE A 186
ASP A 184
None
1.25A 4dtaA-5tv2A:
undetectable
4dtaA-5tv2A:
23.15
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.
5u2i NUCLEOSIDE
DIPHOSPHATE KINASE


(Naegleria
fowleri)
PF00334
(NDK)
5 ALA A  86
ILE A  90
ILE A 115
LEU A  10
ILE A  23
None
1.12A 4dtaA-5u2iA:
undetectable
4dtaA-5u2iA:
19.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u9p GLUCONATE
5-DEHYDROGENASE


(Burkholderia
cenocepacia)
PF13561
(adh_short_C2)
5 ALA A  15
ILE A  17
ILE A 146
LEU A 189
ILE A 144
None
None
NAP  A 301 (-4.4A)
None
None
1.30A 4dtaA-5u9pA:
undetectable
4dtaA-5u9pA:
19.11
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.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)


(Corynebacterium
freiburgense)
PF00171
(Aldedh)
PF01619
(Pro_dh)
5 ALA A 358
ILE A 347
ILE A 293
LEU A 273
ILE A 335
None
1.19A 4dtaA-5ux5A:
undetectable
4dtaA-5ux5A:
13.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v1s RADICAL SAM

(Streptococcus
suis)
PF04055
(Radical_SAM)
PF13394
(Fer4_14)
5 ILE A 191
PRO A 162
ILE A 168
LEU A 172
ILE A 184
None
0.93A 4dtaA-5v1sA:
undetectable
4dtaA-5v1sA:
22.29
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.
5wb1 ENVELOPE PROTEIN
US28, NANOBODY 7
FUSION PROTEIN


(Human
betaherpesvirus
5;
Lama glama)
no annotation 5 ALA A 132
ILE A 133
ILE A 226
LEU A 230
ILE A1101
None
1.31A 4dtaA-5wb1A:
undetectable
4dtaA-5wb1A:
13.10
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.
5xsy SODIUM CHANNEL
PROTEIN


(Electrophorus
electricus)
PF00520
(Ion_trans)
PF06512
(Na_trans_assoc)
5 ALA A 668
ILE A 678
ILE A 680
LEU A1258
ILE A 676
None
1.02A 4dtaA-5xsyA:
undetectable
4dtaA-5xsyA:
10.38
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.
5xuo POLYKETIDE SYNTHASE
PKS13


(Mycobacterium
tuberculosis)
no annotation 5 ALA A 806
ILE A 781
ILE A 741
HIS A 723
ILE A 779
None
1.15A 4dtaA-5xuoA:
undetectable
4dtaA-5xuoA:
17.67
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.
6b8d ELONGATION FACTOR G

(Haemophilus
influenzae)
no annotation 5 ALA A 281
ILE A 248
LEU A 222
ILE A 186
ASP A 184
None
1.29A 4dtaA-6b8dA:
undetectable
4dtaA-6b8dA:
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.
6c8v COENZYME PQQ
SYNTHESIS PROTEIN E


(Methylobacterium
extorquens)
no annotation 5 ILE A 219
ILE A 233
LEU A 188
ILE A 177
ASP A 178
None
1.30A 4dtaA-6c8vA:
undetectable
4dtaA-6c8vA:
11.97
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.
6cey BIFUNCTIONAL AAC/APH

(Staphylococcus
aureus)
no annotation 7 ALA A 216
ILE A 224
LYS A 226
PRO A 258
ILE A 277
HIS A 379
ILE A 392
GNP  A 500 ( 3.9A)
GNP  A 500 (-3.7A)
GNP  A 500 (-2.7A)
None
GNP  A 500 (-3.8A)
MG  A 700 ( 3.2A)
GNP  A 500 (-3.9A)
0.57A 4dtaA-6ceyA:
30.7
4dtaA-6ceyA:
14.38
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.
6cey BIFUNCTIONAL AAC/APH

(Staphylococcus
aureus)
no annotation 7 ALA A 216
ILE A 224
PRO A 258
ILE A 277
HIS A 379
LEU A 381
ILE A 392
GNP  A 500 ( 3.9A)
GNP  A 500 (-3.7A)
None
GNP  A 500 (-3.8A)
MG  A 700 ( 3.2A)
None
GNP  A 500 (-3.9A)
0.62A 4dtaA-6ceyA:
30.7
4dtaA-6ceyA:
14.38
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.
6cey BIFUNCTIONAL AAC/APH

(Staphylococcus
aureus)
no annotation 5 ALA A 216
LYS A 226
PRO A 258
HIS A 379
ASP A 393
GNP  A 500 ( 3.9A)
GNP  A 500 (-2.7A)
None
MG  A 700 ( 3.2A)
MG  A 702 (-1.7A)
1.00A 4dtaA-6ceyA:
30.7
4dtaA-6ceyA:
14.38
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.
6cfw MONOVALENT CATION/H+
ANTIPORTER SUBUNIT C
MONOVALENT CATION/H+
ANTIPORTER SUBUNIT D


(Pyrococcus
furiosus)
no annotation 5 ALA H 241
LYS H 168
ILE H 167
HIS G 103
ILE H 163
None
1.25A 4dtaA-6cfwH:
undetectable
4dtaA-6cfwH:
13.16
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.
6geb DOTB

(Legionella
pneumophila)
no annotation 5 ALA A  28
ILE A  36
ILE A 120
LEU A  68
ILE A  38
None
1.26A 4dtaA-6gebA:
undetectable
4dtaA-6gebA:
14.08