SIMILAR PATTERNS OF AMINO ACIDS FOR 4DT8_B_ADNB401

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.
1aj8 CITRATE SYNTHASE

(Pyrococcus
furiosus)
PF00285
(Citrate_synt)
5 GLY A 125
ILE A 338
ILE A 215
LEU A 212
ILE A 102
None
1.01A 4dt8B-1aj8A:
undetectable
4dt8B-1aj8A:
21.71
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.
1ci9 PROTEIN
(CARBOXYLESTERASE)


(Burkholderia
gladioli)
PF00144
(Beta-lactamase)
5 SER A 272
GLY A 274
ALA A 275
ILE A 148
LEU A 166
None
None
DFP  A 401 (-3.2A)
None
None
1.05A 4dt8B-1ci9A:
undetectable
4dt8B-1ci9A:
19.70
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.
1g8k ARSENITE OXIDASE

(Alcaligenes
faecalis)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
5 SER A 367
ALA A 363
ILE A 274
ILE A 231
LEU A 400
None
1.07A 4dt8B-1g8kA:
undetectable
4dt8B-1g8kA:
16.30
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.
1ldi GLYCEROL UPTAKE
FACILITATOR PROTEIN


(Escherichia
coli)
PF00230
(MIP)
5 GLY A  51
ALA A  55
ILE A  56
ILE A 163
LEU A 159
None
1.09A 4dt8B-1ldiA:
undetectable
4dt8B-1ldiA:
21.58
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.
1nw1 CHOLINE KINASE (49.2
KD)


(Caenorhabditis
elegans)
PF01633
(Choline_kinase)
5 GLY A  84
PRO A 139
ILE A 154
LEU A 262
ILE A 300
None
1.08A 4dt8B-1nw1A:
14.2
4dt8B-1nw1A:
22.57
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.
1oh9 ACETYLGLUTAMATE
KINASE


(Escherichia
coli)
PF00696
(AA_kinase)
5 GLY A 173
ALA A 174
ILE A   6
PRO A 143
ILE A 133
None
0.97A 4dt8B-1oh9A:
undetectable
4dt8B-1oh9A:
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.
1pe9 PECTATE LYASE A

(Dickeya
chrysanthemi)
PF00544
(Pec_lyase_C)
5 SER A 193
GLY A 151
ALA A 152
ILE A 148
ILE A 106
None
1.06A 4dt8B-1pe9A:
undetectable
4dt8B-1pe9A:
19.95
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.
1pmj BETA-1,4-MANNANASE

(Caldicellulosiruptor
saccharolyticus)
PF09212
(CBM27)
5 GLY X 127
ALA X 126
ILE X 122
ILE X 173
ILE X  91
EDO  X 401 (-3.4A)
EDO  X 401 ( 4.2A)
None
None
None
1.05A 4dt8B-1pmjX:
undetectable
4dt8B-1pmjX:
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.
1puj CONSERVED
HYPOTHETICAL PROTEIN
YLQF


(Bacillus
subtilis)
PF01926
(MMR_HSR1)
5 SER A 100
ALA A  99
ILE A  54
LEU A 136
ILE A  85
None
1.06A 4dt8B-1pujA:
undetectable
4dt8B-1pujA:
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.
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
1.04A 4dt8B-1pweA:
undetectable
4dt8B-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.
1qlb FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT


(Wolinella
succinogenes)
PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
5 SER A 390
ALA A 394
ILE A 375
LEU A 184
ILE A 239
None
1.06A 4dt8B-1qlbA:
undetectable
4dt8B-1qlbA:
17.99
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.
1rlm PHOSPHATASE

(Escherichia
coli)
PF08282
(Hydrolase_3)
5 ALA A 236
PRO A 159
ILE A 162
ILE A 158
ASP A 155
None
1.07A 4dt8B-1rlmA:
undetectable
4dt8B-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
1.02A 4dt8B-1s4dA:
undetectable
4dt8B-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.
1t3d SERINE
ACETYLTRANSFERASE


(Escherichia
coli)
PF00132
(Hexapep)
PF06426
(SATase_N)
5 GLY A 165
ALA A 168
ILE A 154
LEU A 156
ILE A 176
None
1.02A 4dt8B-1t3dA:
undetectable
4dt8B-1t3dA:
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.
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
1.07A 4dt8B-1un9A:
undetectable
4dt8B-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.
1v6c ALKALINE SERINE
PROTEASE


(Pseudoalteromonas
sp. AS-11)
PF00082
(Peptidase_S8)
PF02225
(PA)
5 GLY A 305
ALA A 303
ILE A 292
LEU A 322
ILE A 329
None
1.06A 4dt8B-1v6cA:
undetectable
4dt8B-1v6cA:
17.87
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.
2bwp 5-AMINOLEVULINATE
SYNTHASE


(Rhodobacter
capsulatus)
PF00155
(Aminotran_1_2)
5 GLY A 208
ALA A 204
ILE A 182
ILE A 135
LEU A 133
None
1.10A 4dt8B-2bwpA:
undetectable
4dt8B-2bwpA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c6x CITRATE SYNTHASE 1

(Bacillus
subtilis)
PF00285
(Citrate_synt)
5 GLY A 335
ALA A 338
ILE A  16
ILE A  27
LEU A  26
None
1.09A 4dt8B-2c6xA:
undetectable
4dt8B-2c6xA:
18.23
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.
2hx1 PREDICTED SUGAR
PHOSPHATASES OF THE
HAD SUPERFAMILY


(Cytophaga
hutchinsonii)
PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6)
5 SER A  82
GLY A  83
ALA A  55
ILE A 199
ILE A 164
None
1.10A 4dt8B-2hx1A:
undetectable
4dt8B-2hx1A:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2obm ESCN

(Escherichia
coli)
PF00006
(ATP-synt_ab)
5 GLY A 193
ALA A 194
ILE A 343
ILE A 161
ASP A 162
None
1.00A 4dt8B-2obmA:
undetectable
4dt8B-2obmA:
21.93
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.
2pjs UNCHARACTERIZED
PROTEIN ATU1953


(Agrobacterium
fabrum)
PF00903
(Glyoxalase)
5 GLY A  83
ALA A  82
ILE A  25
ILE A 112
LEU A 100
None
1.08A 4dt8B-2pjsA:
undetectable
4dt8B-2pjsA:
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.
2ps2 PUTATIVE MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME


(Aspergillus
oryzae)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 GLY A 279
ALA A 273
LYS A 272
ILE A 257
ILE A 266
None
1.10A 4dt8B-2ps2A:
undetectable
4dt8B-2ps2A:
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.
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
1.05A 4dt8B-2q1dX:
undetectable
4dt8B-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)
0.87A 4dt8B-2q83A:
14.4
4dt8B-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.
2qi2 CELL DIVISION
PROTEIN PELOTA
RELATED PROTEIN


(Thermoplasma
acidophilum)
PF03463
(eRF1_1)
PF03465
(eRF1_3)
5 GLY A 329
ILE A 286
ILE A 311
LEU A 301
ILE A 313
None
1.10A 4dt8B-2qi2A:
undetectable
4dt8B-2qi2A:
23.66
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.
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
1.01A 4dt8B-2qipA:
undetectable
4dt8B-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.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN


(Azospirillum
brasilense)
PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central)
5 GLY A1277
ALA A1280
ILE A1284
ILE A1215
ASP A1212
None
1.01A 4dt8B-2vdcA:
undetectable
4dt8B-2vdcA:
12.02
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.
2vr2 DIHYDROPYRIMIDINASE

(Homo sapiens)
PF01979
(Amidohydro_1)
5 GLY A 444
ALA A 401
ILE A 405
LEU A  52
ILE A   9
None
1.09A 4dt8B-2vr2A:
undetectable
4dt8B-2vr2A:
19.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wwd 1,4-BETA-N-ACETYLMUR
AMIDASE


(Streptococcus
pneumoniae)
PF01183
(Glyco_hydro_25)
PF01473
(CW_binding_1)
5 GLY A 398
ALA A 397
ILE A 346
LEU A 356
ILE A 360
None
1.04A 4dt8B-2wwdA:
undetectable
4dt8B-2wwdA:
18.74
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.
2z2n VIRGINIAMYCIN B
LYASE


(Staphylococcus
aureus)
no annotation 5 SER A 183
GLY A 184
ILE A 178
ILE A 209
ILE A 164
None
1.07A 4dt8B-2z2nA:
undetectable
4dt8B-2z2nA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zl3 ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT


(Helicobacter
pylori)
PF00574
(CLP_protease)
5 SER A  67
GLY A  35
ILE A  37
LEU A  63
ILE A  45
None
1.09A 4dt8B-2zl3A:
undetectable
4dt8B-2zl3A:
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.
3afg SUBTILISIN-LIKE
SERINE PROTEASE


(Thermococcus
kodakarensis)
PF00082
(Peptidase_S8)
PF04151
(PPC)
5 SER A 515
ALA A 445
ILE A 442
PRO A 468
LEU A 465
None
0.94A 4dt8B-3afgA:
undetectable
4dt8B-3afgA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
1.11A 4dt8B-3e18A:
undetectable
4dt8B-3e18A:
21.89
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.
3gvd SERINE
ACETYLTRANSFERASE


(Yersinia pestis)
PF00132
(Hexapep)
PF06426
(SATase_N)
5 GLY A 165
ALA A 168
ILE A 154
LEU A 156
ILE A 176
CYS  A 501 ( 4.5A)
None
None
None
None
1.10A 4dt8B-3gvdA:
undetectable
4dt8B-3gvdA:
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.
3h5q PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE


(Staphylococcus
aureus)
PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C)
5 GLY A 362
ALA A 363
ILE A 354
LEU A 411
ILE A 378
None
0.89A 4dt8B-3h5qA:
undetectable
4dt8B-3h5qA:
22.60
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
0.43A 4dt8B-3hamA:
32.6
4dt8B-3hamA:
34.53
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.
3iwj PUTATIVE
AMINOALDEHYDE
DEHYDROGENASE


(Pisum sativum)
PF00171
(Aldedh)
5 GLY A 372
PRO A 397
ILE A 345
LEU A 346
ILE A 375
None
0.97A 4dt8B-3iwjA:
undetectable
4dt8B-3iwjA:
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.
3j7a 40S RIBOSOMAL
PROTEIN ES21
40S RIBOSOMAL
PROTEIN US2


(Plasmodium
falciparum)
PF00318
(Ribosomal_S2)
PF01249
(Ribosomal_S21e)
5 GLY Z  37
ALA C  66
PRO C 142
LEU Z  68
ILE Z  34
None
0.82A 4dt8B-3j7aZ:
undetectable
4dt8B-3j7aZ:
13.36
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.
3lly AGGLUTININ ALPHA
CHAIN


(Maclura
pomifera)
PF01419
(Jacalin)
5 GLY A 118
ILE A 120
ILE A  25
LEU A  84
ILE A  81
None
1.07A 4dt8B-3llyA:
undetectable
4dt8B-3llyA:
20.53
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.
3lm5 SERINE/THREONINE-PRO
TEIN KINASE 17B


(Homo sapiens)
PF00069
(Pkinase)
5 GLY A 222
ALA A 225
ILE A 139
ILE A 175
ILE A 118
None
1.11A 4dt8B-3lm5A:
5.5
4dt8B-3lm5A:
23.32
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.
3lou FORMYLTETRAHYDROFOLA
TE DEFORMYLASE


(Burkholderia
mallei)
PF00551
(Formyl_trans_N)
5 SER A 169
ALA A 171
ILE A 127
LEU A 143
ILE A 124
None
1.11A 4dt8B-3louA:
undetectable
4dt8B-3louA:
21.02
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 SER A  28
GLY A  29
ALA A  36
ILE A  44
LYS A  46
PRO A  76
ILE A  98
LEU A 204
ILE A 216
ASP A 217
None
0.68A 4dt8B-3n4tA:
42.5
4dt8B-3n4tA:
100.00
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.
3nd0 SLL0855 PROTEIN

(Synechocystis
sp. PCC 6803)
PF00654
(Voltage_CLC)
5 GLY A 151
ILE A 108
PRO A 201
LEU A 194
ILE A 195
None
1.10A 4dt8B-3nd0A:
undetectable
4dt8B-3nd0A:
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.
3nxk CYTOPLASMIC
L-ASPARAGINASE


(Campylobacter
jejuni)
PF00710
(Asparaginase)
5 ALA A  59
ILE A  58
ILE A  78
LEU A 105
ILE A  91
None
1.00A 4dt8B-3nxkA:
undetectable
4dt8B-3nxkA:
23.27
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.
3nzg PUTATIVE RACEMASE

(Pseudovibrio
sp. JE062)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 GLY A 103
ALA A 106
ILE A  71
LEU A  68
ILE A  61
None
1.03A 4dt8B-3nzgA:
undetectable
4dt8B-3nzgA:
23.21
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.
3qqz PUTATIVE
UNCHARACTERIZED
PROTEIN YJIK


(Escherichia
coli)
PF06977
(SdiA-regulated)
5 GLY A 219
ILE A 178
PRO A 181
ILE A 180
ILE A 228
None
1.06A 4dt8B-3qqzA:
undetectable
4dt8B-3qqzA:
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.
3qwb PROBABLE QUINONE
OXIDOREDUCTASE


(Saccharomyces
cerevisiae)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
5 GLY A 129
PRO A 110
ILE A 277
LEU A 273
ILE A  94
None
None
None
NDP  A 335 (-4.8A)
None
1.03A 4dt8B-3qwbA:
undetectable
4dt8B-3qwbA:
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.
3tdw GENTAMICIN
RESISTANCE PROTEIN


(Enterococcus
gallinarum)
PF01636
(APH)
5 GLY A  28
ALA A  35
PRO A  75
LEU A 203
ILE A 217
GDP  A 500 (-3.4A)
GDP  A 500 (-3.6A)
None
None
GDP  A 500 ( 4.1A)
0.37A 4dt8B-3tdwA:
29.9
4dt8B-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.
3wb1 UNCHARACTERIZED
PROTEIN MJ0488


(Methanocaldococcus
jannaschii)
PF11576
(DUF3236)
5 ALA A  64
ILE A  66
ILE A  54
LEU A 147
ILE A 100
None
0.93A 4dt8B-3wb1A:
undetectable
4dt8B-3wb1A:
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.
3zw6 RIBULOSE
BISPHOSPHATE
CARBOXYLASE/OXYGENAS
E ACTIVASE 1,
CHLOROPLASTIC


(Nicotiana
tabacum)
PF00004
(AAA)
5 GLY A 128
PRO A 224
ILE A 226
LEU A  86
ILE A  90
None
0.90A 4dt8B-3zw6A:
undetectable
4dt8B-3zw6A:
21.51
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.
4c5f MEMBRANE-BOUND LYTIC
MUREIN
TRANSGLYCOSYLASE C


(Escherichia
coli)
PF01464
(SLT)
PF11873
(DUF3393)
5 SER A 152
GLY A 149
ALA A 151
ILE A 104
ILE A 127
None
1.00A 4dt8B-4c5fA:
undetectable
4dt8B-4c5fA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cn8 PROXIMAL THREAD
MATRIX PROTEIN 1


(Mytilus
galloprovincialis)
PF00092
(VWA)
5 GLY A 204
PRO A 182
ILE A 213
LEU A 170
ILE A 141
None
0.82A 4dt8B-4cn8A:
undetectable
4dt8B-4cn8A:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 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 4dt8B-4da5A:
15.8
4dt8B-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.
4gji L-RHAMNOSE ISOMERASE

(Pseudomonas
stutzeri)
no annotation 5 SER A 409
GLY A 410
ILE A  88
ILE A 336
ASP A 334
None
1.03A 4dt8B-4gjiA:
undetectable
4dt8B-4gjiA:
19.55
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.
4h3w HYPOTHETICAL PROTEIN

(Parabacteroides
distasonis)
PF15414
(DUF4621)
5 GLY A  76
ILE A  99
ILE A 138
LEU A 136
ILE A 121
None
0.98A 4dt8B-4h3wA:
undetectable
4dt8B-4h3wA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h7o SERINE
ACETYLTRANSFERASE


(Vibrio cholerae)
PF00132
(Hexapep)
PF06426
(SATase_N)
5 GLY A 165
ALA A 168
ILE A 154
LEU A 156
ILE A 176
CYS  A 301 ( 4.6A)
None
None
None
None
1.00A 4dt8B-4h7oA:
undetectable
4dt8B-4h7oA:
22.75
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.
4ifd EXOSOME COMPLEX
COMPONENT RRP43


(Saccharomyces
cerevisiae)
PF01138
(RNase_PH)
5 GLY C 364
ILE C 299
ILE C 331
LEU C 334
ILE C 343
None
0.99A 4dt8B-4ifdC:
undetectable
4dt8B-4ifdC:
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.
4jq9 DIHYDROLIPOYL
DEHYDROGENASE


(Escherichia
coli)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 GLY A  18
ALA A  17
ILE A 311
ILE A 295
ILE A 314
None
FAD  A 512 (-3.4A)
None
None
None
1.05A 4dt8B-4jq9A:
undetectable
4dt8B-4jq9A:
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.
4kpr THIOREDOXIN
REDUCTASE 1,
CYTOPLASMIC


(Rattus
norvegicus)
no annotation 5 GLY E  23
ALA E 160
ILE E  17
LEU E 120
ASP E  42
FAD  E 505 (-3.6A)
FAD  E 505 (-4.6A)
None
None
FAD  E 505 (-2.7A)
1.11A 4dt8B-4kprE:
undetectable
4dt8B-4kprE:
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.
4kwg ALDEHYDE
DEHYDROGENASE,
MITOCHONDRIAL


(Homo sapiens)
PF00171
(Aldedh)
5 GLY A 378
PRO A 403
ILE A 353
LEU A 354
ILE A 381
None
1.02A 4dt8B-4kwgA:
undetectable
4dt8B-4kwgA:
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.
4lqz UNCHARACTERIZED
PROTEIN


(Staphylococcus
aureus)
PF16253
(DUF4909)
5 ALA A  65
ILE A  83
ILE A  38
LEU A 154
ILE A  48
None
1.11A 4dt8B-4lqzA:
undetectable
4dt8B-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.
4lrj EFFECTOR NLEH1

(Escherichia
coli)
no annotation 5 GLY A 140
LYS A 159
ILE A 204
LEU A 246
ILE A 257
ANP  A 301 ( 3.9A)
ANP  A 301 (-3.6A)
ANP  A 301 (-4.3A)
None
ANP  A 301 (-4.2A)
0.87A 4dt8B-4lrjA:
7.8
4dt8B-4lrjA:
20.59
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.
4na3 POLYKETIDE SYNTHASE
PKSJ


(Bacillus
subtilis)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
6 GLY A 201
ALA A 200
ILE A 183
ILE A 442
LEU A 374
ILE A   9
None
1.10A 4dt8B-4na3A:
undetectable
4dt8B-4na3A:
18.76
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.
4ohq TRIOSEPHOSPHATE
ISOMERASE,
CHLOROPLASTIC


(Arabidopsis
thaliana)
PF00121
(TIM)
5 SER A  63
GLY A  64
ILE A 125
ILE A 161
LEU A 118
None
1.01A 4dt8B-4ohqA:
undetectable
4dt8B-4ohqA:
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.
4om9 SERINE PROTEASE PET

(Escherichia
coli)
PF02395
(Peptidase_S6)
5 SER A 569
ALA A 520
ILE A 621
ILE A 640
ILE A 472
None
1.04A 4dt8B-4om9A:
undetectable
4dt8B-4om9A:
14.61
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.
4om9 SERINE PROTEASE PET

(Escherichia
coli)
PF02395
(Peptidase_S6)
5 SER A 569
ILE A 621
ILE A 640
ILE A 472
ASP A 499
None
1.03A 4dt8B-4om9A:
undetectable
4dt8B-4om9A:
14.61
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.
4tkt AT-LESS POLYKETIDE
SYNTHASE


(Streptomyces
platensis)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
5 GLY A3345
ALA A3344
ILE A3327
LEU A3509
ILE A3145
None
1.03A 4dt8B-4tktA:
undetectable
4dt8B-4tktA:
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.
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
1.10A 4dt8B-4tr6A:
undetectable
4dt8B-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.
4u7d ATP-DEPENDENT DNA
HELICASE Q1


(Homo sapiens)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF16124
(RecQ_Zn_bind)
5 GLY A 573
ALA A 576
ILE A 497
ILE A 499
LEU A 515
None
1.08A 4dt8B-4u7dA:
undetectable
4dt8B-4u7dA:
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.
4u8g PUTATIVE
UNCHARACTERIZED
PROTEIN GBS1891


(Streptococcus
agalactiae)
PF13561
(adh_short_C2)
5 GLY A  21
ALA A  22
ILE A  19
ILE A 146
ILE A 148
None
1.09A 4dt8B-4u8gA:
undetectable
4dt8B-4u8gA:
22.81
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.
4up3 THIOREDOXIN
REDUCTASE


(Entamoeba
histolytica)
PF07992
(Pyr_redox_2)
5 SER A 299
GLY A 300
ALA A  15
ILE A 267
ILE A 115
None
None
FAD  A1315 (-3.3A)
None
None
0.97A 4dt8B-4up3A:
undetectable
4dt8B-4up3A:
17.95
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.
4w5w RIBULOSE
BISPHOSPHATE
CARBOXYLASE/OXYGENAS
E ACTIVASE,
CHLOROPLASTIC


(Arabidopsis
thaliana)
PF00004
(AAA)
5 GLY A 125
PRO A 221
ILE A 223
LEU A  83
ILE A  87
None
0.91A 4dt8B-4w5wA:
undetectable
4dt8B-4w5wA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w7v CELLULASE

(Xanthomonas
citri)
PF00150
(Cellulase)
5 GLY A 108
ALA A 107
ILE A 100
PRO A 135
LEU A  89
None
1.09A 4dt8B-4w7vA:
undetectable
4dt8B-4w7vA:
18.42
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.
4wh3 N-ACETYLHEXOSAMINE
1-KINASE


(Bifidobacterium
longum)
PF01636
(APH)
5 GLY A  28
ILE A  46
ILE A 105
LEU A 215
ILE A 227
ATP  A 401 (-3.3A)
ATP  A 401 (-4.1A)
ATP  A 401 (-3.9A)
GOL  A 404 ( 4.7A)
ATP  A 401 (-4.1A)
0.87A 4dt8B-4wh3A:
16.4
4dt8B-4wh3A:
23.97
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.
4wr2 PYRIMIDINE-SPECIFIC
RIBONUCLEOSIDE
HYDROLASE RIHA


(Shewanella
loihica)
PF01156
(IU_nuc_hydro)
5 GLY A 112
ALA A 150
ILE A 151
ILE A 180
ILE A 176
None
1.02A 4dt8B-4wr2A:
undetectable
4dt8B-4wr2A:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yzw AGAP004976-PA

(Anopheles
gambiae)
PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C)
5 GLY A 376
ILE A 362
ILE A 335
LEU A 332
ILE A 425
None
1.10A 4dt8B-4yzwA:
undetectable
4dt8B-4yzwA:
17.09
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.
4z37 PUTATIVE MIXED
POLYKETIDE
SYNTHASE/NON-RIBOSOM
AL PEPTIDE
SYNTHETASE


(Brevibacillus
brevis)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
6 GLY A2521
ALA A2520
ILE A2503
ILE A2756
LEU A2685
ILE A2325
None
1.15A 4dt8B-4z37A:
undetectable
4dt8B-4z37A:
18.96
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.
4zoq INTRACELLULAR SERINE
PROTEASE


(Bacillus
licheniformis)
PF00082
(Peptidase_S8)
5 GLY I 274
ALA I 273
ILE I 321
ILE I 425
ILE I 311
None
1.10A 4dt8B-4zoqI:
undetectable
4dt8B-4zoqI:
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.
5abm RETINAL
DEHYDROGENASE 1


(Ovis aries)
PF00171
(Aldedh)
5 GLY A 378
PRO A 403
ILE A 353
LEU A 354
ILE A 381
None
0.95A 4dt8B-5abmA:
undetectable
4dt8B-5abmA:
21.56
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.
5b69 GERANYLGERANYLGLYCER
YL PHOSPHATE
SYNTHASE


(Thermoplasma
acidophilum)
PF01884
(PcrB)
5 GLY A 224
ALA A 227
ILE A  35
ILE A  67
ILE A  47
1GP  A 501 (-3.4A)
None
None
None
None
0.86A 4dt8B-5b69A:
undetectable
4dt8B-5b69A:
20.95
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.
5dkv ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (RIBOSE)


(Agrobacterium
vitis)
PF13407
(Peripla_BP_4)
5 GLY A 288
ALA A 292
ILE A  35
PRO A  90
ILE A  66
None
1.01A 4dt8B-5dkvA:
undetectable
4dt8B-5dkvA:
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.
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
1.04A 4dt8B-5e7sA:
undetectable
4dt8B-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)
6 GLY A 208
ALA A 207
ILE A 190
ILE A 443
LEU A 372
ILE A  11
None
1.14A 4dt8B-5erbA:
undetectable
4dt8B-5erbA:
18.10
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.
5evj ARSENITE
METHYLTRANSFERASE


(Chlamydomonas
reinhardtii)
PF13847
(Methyltransf_31)
5 GLY A 113
ALA A  92
PRO A  77
ILE A  78
ILE A 167
None
0.95A 4dt8B-5evjA:
undetectable
4dt8B-5evjA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fhz ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3


(Homo sapiens)
PF00171
(Aldedh)
5 GLY A 390
PRO A 415
ILE A 365
LEU A 366
ILE A 393
None
1.11A 4dt8B-5fhzA:
undetectable
4dt8B-5fhzA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fmg PROTEASOME SUBUNIT
BETA TYPE


(Plasmodium
falciparum)
PF00227
(Proteasome)
5 GLY N  53
ILE N  23
ILE N 206
LEU N 210
ILE N  13
None
1.10A 4dt8B-5fmgN:
undetectable
4dt8B-5fmgN:
21.82
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.
5gkm AT5G51070/K3K7_27

(Arabidopsis
thaliana)
PF02861
(Clp_N)
5 GLY A 114
ALA A 117
ILE A 132
LEU A 215
ILE A 130
None
0.98A 4dt8B-5gkmA:
undetectable
4dt8B-5gkmA:
15.74
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.
5h1y PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX41


(Homo sapiens)
PF00270
(DEAD)
5 GLY A 223
ALA A 225
ILE A 207
ILE A 209
ILE A 169
None
0.94A 4dt8B-5h1yA:
undetectable
4dt8B-5h1yA:
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.
5h78 CAMP-DEPENDENT
PROTEIN KINASE TYPE
II-ALPHA REGULATORY
SUBUNIT,DHR14


(Homo sapiens;
synthetic
construct)
PF02197
(RIIa)
5 ALA A 132
ILE A 147
ILE A 145
LEU A 183
ILE A 187
None
1.04A 4dt8B-5h78A:
undetectable
4dt8B-5h78A:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jgp NITRATE/NITRITE
SENSOR PROTEIN NARQ


(Escherichia
coli)
PF00672
(HAMP)
PF13675
(PilJ)
5 SER A  80
ALA A  77
ILE A  45
ILE A  43
LEU A 139
None
1.00A 4dt8B-5jgpA:
2.3
4dt8B-5jgpA:
20.39
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.
5nek PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE


(Bacillus cereus)
no annotation 5 GLY A  78
PRO A 160
ILE A 156
ILE A 152
ASP A 148
None
1.08A 4dt8B-5nekA:
undetectable
4dt8B-5nekA:
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.
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
0.72A 4dt8B-5v1sA:
undetectable
4dt8B-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.
5vip MDCE

(Pseudomonas
aeruginosa)
PF06833
(MdcE)
5 GLY A 232
ALA A 234
ILE A 133
ILE A  94
LEU A  16
None
1.06A 4dt8B-5vipA:
undetectable
4dt8B-5vipA:
15.48
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.
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
1.06A 4dt8B-5xsyA:
undetectable
4dt8B-5xsyA:
10.44
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.
5zbi PEPTIDE ASPARAGINYL
LIGASE


(Viola
canadensis)
no annotation 5 SER A 459
GLY A 456
ALA A 458
ILE A 385
ILE A 445
None
0.97A 4dt8B-5zbiA:
undetectable
4dt8B-5zbiA:
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.
5zvt C-TERMINUS OF OUTER
CAPSID PROTEIN VP5


(Aquareovirus C)
no annotation 5 SER B 500
ALA B 304
ILE B 299
LEU B 464
ILE B 339
None
1.06A 4dt8B-5zvtB:
undetectable
4dt8B-5zvtB:
13.70
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.
6b5i RETINAL
DEHYDROGENASE 2


(Homo sapiens)
no annotation 5 GLY A 396
PRO A 421
ILE A 371
LEU A 372
ILE A 399
None
0.92A 4dt8B-6b5iA:
undetectable
4dt8B-6b5iA:
12.20
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.
6cey BIFUNCTIONAL AAC/APH

(Staphylococcus
aureus)
no annotation 6 GLY A 209
ALA A 216
ILE A 224
LYS A 226
PRO A 258
ASP A 393
GNP  A 500 ( 4.3A)
GNP  A 500 ( 3.9A)
GNP  A 500 (-3.7A)
GNP  A 500 (-2.7A)
None
MG  A 702 (-1.7A)
0.89A 4dt8B-6ceyA:
30.6
4dt8B-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 GLY A 209
ALA A 216
ILE A 224
LYS A 226
PRO A 258
ILE A 277
ILE A 392
GNP  A 500 ( 4.3A)
GNP  A 500 ( 3.9A)
GNP  A 500 (-3.7A)
GNP  A 500 (-2.7A)
None
GNP  A 500 (-3.8A)
GNP  A 500 (-3.9A)
0.61A 4dt8B-6ceyA:
30.6
4dt8B-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 GLY A 209
ALA A 216
ILE A 224
PRO A 258
ILE A 277
LEU A 381
ILE A 392
GNP  A 500 ( 4.3A)
GNP  A 500 ( 3.9A)
GNP  A 500 (-3.7A)
None
GNP  A 500 (-3.8A)
None
GNP  A 500 (-3.9A)
0.66A 4dt8B-6ceyA:
30.6
4dt8B-6ceyA:
14.38