SIMILAR PATTERNS OF AMINO ACIDS FOR 5DZK_T_BEZT801_0

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.
1e5w MOESIN

(Homo sapiens) 		PF00373
(FERM_M)
PF09379
(FERM_N)
PF09380
(FERM_C) 		4 SER A 127
ALA A 126
HIS A 179
LEU A 124
 None
 1.11A 5dzkf-1e5wA:
undetectable
5dzkt-1e5wA:
undetectable		 5dzkf-1e5wA:
21.01
5dzkt-1e5wA:
2.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eco ERYTHROCRUORIN
(CARBONMONOXY)

(Chironomus
thummi) 		PF00042
(Globin) 		4 SER A  86
ALA A  85
HIS A  87
MET A 136
 HEM  A 137 ( 3.7A)
None
HEM  A 137 (-3.3A)
None
 0.94A 5dzkf-1ecoA:
undetectable
5dzkt-1ecoA:
undetectable		 5dzkf-1ecoA:
22.12
5dzkt-1ecoA:
4.35
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.
1ex9 LACTONIZING LIPASE

(Pseudomonas
aeruginosa) 		PF00561
(Abhydrolase_1) 		4 SER A  82
ALA A 107
HIS A 251
LEU A 162
 OCP  A 382 (-1.5A)
None
OCP  A 382 (-3.9A)
OCP  A 382 ( 4.4A)
 1.25A 5dzkf-1ex9A:
0.5
5dzkt-1ex9A:
undetectable		 5dzkf-1ex9A:
23.79
5dzkt-1ex9A:
0.70
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.
1flk TNF RECEPTOR
ASSOCIATED FACTOR 3

(Homo sapiens) 		no annotation 4 SER A 378
ALA A 392
MET A 414
LEU A 354
 None
 1.02A 5dzkf-1flkA:
undetectable
5dzkt-1flkA:
undetectable		 5dzkf-1flkA:
21.94
5dzkt-1flkA:
1.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gc7 RADIXIN

(Mus musculus) 		PF00373
(FERM_M)
PF09379
(FERM_N)
PF09380
(FERM_C) 		4 SER A 127
ALA A 126
HIS A 179
LEU A 124
 SER  A 127 ( 0.0A)
ALA  A 126 ( 0.0A)
HIS  A 179 ( 1.0A)
LEU  A 124 ( 0.6A)
 1.06A 5dzkf-1gc7A:
0.0
5dzkt-1gc7A:
undetectable		 5dzkf-1gc7A:
19.68
5dzkt-1gc7A:
1.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gtk PORPHOBILINOGEN
DEAMINASE

(Escherichia
coli) 		PF01379
(Porphobil_deam)
PF03900
(Porphobil_deamC) 		4 SER A  30
ALA A  29
HIS A  31
LEU A 219
 None
 1.38A 5dzkf-1gtkA:
0.0
5dzkt-1gtkA:
undetectable		 5dzkf-1gtkA:
24.61
5dzkt-1gtkA:
33.33
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.
1idt MINOR FMN-DEPENDENT
NITROREDUCTASE

(Escherichia
coli) 		PF00881
(Nitroreductase) 		4 SER A  79
ALA A  78
HIS A  80
LEU A 159
 None
 1.41A 5dzkf-1idtA:
0.0
5dzkt-1idtA:
undetectable		 5dzkf-1idtA:
24.19
5dzkt-1idtA:
1.32
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.
1jmk SURFACTIN SYNTHETASE

(Bacillus
subtilis) 		PF00975
(Thioesterase) 		4 SER C  80
ALA C  81
HIS C 207
LEU C 129
 None
 1.30A 5dzkf-1jmkC:
1.5
5dzkt-1jmkC:
undetectable		 5dzkf-1jmkC:
22.92
5dzkt-1jmkC:
1.15
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.
1jzn GALACTOSE-SPECIFIC
LECTIN

(Crotalus atrox) 		PF00059
(Lectin_C) 		4 SER A  42
ALA A  41
HIS A  44
LEU A  13
 NA  A1139 (-2.9A)
None
None
None
 1.02A 5dzkf-1jznA:
undetectable
5dzkt-1jznA:
undetectable		 5dzkf-1jznA:
18.02
5dzkt-1jznA:
15.38
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.
1lur ALDOSE 1-EPIMERASE

(Caenorhabditis
elegans) 		PF01263
(Aldose_epim) 		4 SER A1056
ALA A1054
HIS A1163
LEU A1091
 None
 1.43A 5dzkf-1lurA:
undetectable
5dzkt-1lurA:
undetectable		 5dzkf-1lurA:
21.78
5dzkt-1lurA:
7.14
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.
1qgo ANAEROBIC COBALAMIN
BIOSYNTHETIC COBALT
CHELATASE

(Salmonella
enterica) 		PF06180
(CbiK) 		4 SER A  32
ALA A  31
HIS A 253
LEU A   5
 None
 1.21A 5dzkf-1qgoA:
2.1
5dzkt-1qgoA:
undetectable		 5dzkf-1qgoA:
21.11
5dzkt-1qgoA:
33.33
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.
1qgo ANAEROBIC COBALAMIN
BIOSYNTHETIC COBALT
CHELATASE

(Salmonella
enterica) 		PF06180
(CbiK) 		4 SER A  32
ALA A  31
HIS A 253
LEU A  29
 None
 1.20A 5dzkf-1qgoA:
2.1
5dzkt-1qgoA:
undetectable		 5dzkf-1qgoA:
21.11
5dzkt-1qgoA:
33.33
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.
1t3i PROBABLE CYSTEINE
DESULFURASE

(Synechocystis
sp.) 		PF00266
(Aminotran_5) 		4 SER A 209
ALA A 210
HIS A 177
LEU A 225
 None
 1.35A 5dzkf-1t3iA:
undetectable
5dzkt-1t3iA:
undetectable		 5dzkf-1t3iA:
18.37
5dzkt-1t3iA:
1.20
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.
1we5 PUTATIVE FAMILY 31
GLUCOSIDASE YICI

(Escherichia
coli) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		4 SER A 268
ALA A 266
HIS A 536
MET A 570
 None
 1.06A 5dzkf-1we5A:
undetectable
5dzkt-1we5A:
undetectable		 5dzkf-1we5A:
13.64
5dzkt-1we5A:
0.26
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.
2g6z DUAL SPECIFICITY
PROTEIN PHOSPHATASE
5

(Homo sapiens) 		PF00782
(DSPc) 		4 SER A 190
ALA A 265
HIS A 193
MET A 299
 None
SO4  A 501 (-3.4A)
None
None
 1.41A 5dzkf-2g6zA:
undetectable
5dzkt-2g6zA:
undetectable		 5dzkf-2g6zA:
23.31
5dzkt-2g6zA:
1.45
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.
2gre DEBLOCKING
AMINOPEPTIDASE

(Bacillus cereus) 		PF05343
(Peptidase_M42) 		4 SER A 329
ALA A 332
HIS A 327
MET A   9
 None
 1.19A 5dzkf-2greA:
undetectable
5dzkt-2greA:
undetectable		 5dzkf-2greA:
20.80
5dzkt-2greA:
3.03
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.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT

(Pseudomonas
stutzeri;
Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox)
PF04945
(YHS)
PF02332
(Phenol_Hydrox) 		4 SER A 108
ALA A 107
HIS B 143
MET A 181
 None
P6G  A 503 ( 3.8A)
None
None
 1.45A 5dzkf-2incA:
undetectable
5dzkt-2incA:
undetectable		 5dzkf-2incA:
19.91
5dzkt-2incA:
0.65
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.
2l8y PROTEIN RCSF

(Escherichia
coli) 		PF16358
(RcsF) 		4 SER A 127
ALA A 128
HIS A 107
MET A  92
 None
 1.27A 5dzkf-2l8yA:
undetectable
5dzkt-2l8yA:
undetectable		 5dzkf-2l8yA:
20.10
5dzkt-2l8yA:
2.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nql ISOMERASE/LACTONIZIN
G ENZYME

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 SER A 327
ALA A 326
HIS A 340
MET A 358
 None
 1.39A 5dzkf-2nqlA:
undetectable
5dzkt-2nqlA:
undetectable		 5dzkf-2nqlA:
19.95
5dzkt-2nqlA:
2.33
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.
2ppg PUTATIVE ISOMERASE

(Sinorhizobium
meliloti) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 SER A 328
ALA A 327
HIS A 341
MET A 359
 None
 1.44A 5dzkf-2ppgA:
undetectable
5dzkt-2ppgA:
undetectable		 5dzkf-2ppgA:
19.85
5dzkt-2ppgA:
2.27
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.
2vj5 PROTEIN MXIC

(Shigella
flexneri) 		PF07201
(HrpJ) 		4 SER A 306
ALA A 305
HIS A 307
LEU A 273
 None
 1.50A 5dzkf-2vj5A:
undetectable
5dzkt-2vj5A:
undetectable		 5dzkf-2vj5A:
22.26
5dzkt-2vj5A:
0.97
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.
2x26 PERIPLASMIC
ALIPHATIC
SULPHONATES-BINDING
PROTEIN

(Escherichia
coli) 		PF09084
(NMT1) 		4 SER A 264
ALA A 263
HIS A 268
LEU A 192
 None
 1.34A 5dzkf-2x26A:
undetectable
5dzkt-2x26A:
undetectable		 5dzkf-2x26A:
23.59
5dzkt-2x26A:
8.00
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.
2y1b PUTATIVE OUTER
MEMBRANE PROTEIN,
SIGNAL

(Escherichia
coli) 		PF16358
(RcsF) 		4 SER A 127
ALA A 128
HIS A 107
MET A  92
 None
None
I3C  A1133 (-3.6A)
None
 1.03A 5dzkf-2y1bA:
undetectable
5dzkt-2y1bA:
undetectable		 5dzkf-2y1bA:
20.72
5dzkt-2y1bA:
2.17
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.
2zuk ALPHA-AMINO-EPSILON-
CAPROLACTAM RACEMASE

(Achromobacter
obae) 		PF00202
(Aminotran_3) 		4 SER A  95
ALA A  94
HIS A 251
LEU A 310
 None
 1.36A 5dzkf-2zukA:
undetectable
5dzkt-2zukA:
undetectable		 5dzkf-2zukA:
20.45
5dzkt-2zukA:
2.08
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.
3bre PROBABLE
TWO-COMPONENT
RESPONSE REGULATOR

(Pseudomonas
aeruginosa) 		PF00072
(Response_reg)
PF00990
(GGDEF) 		4 SER A 180
ALA A 248
HIS A 184
LEU A 246
 None
 1.35A 5dzkf-3breA:
undetectable
5dzkt-3breA:
undetectable		 5dzkf-3breA:
19.83
5dzkt-3breA:
8.70
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.
3hf1 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SUBUNIT M2 B

(Homo sapiens) 		PF00268
(Ribonuc_red_sm) 		4 SER A 201
ALA A 204
MET A 282
LEU A 270
 None
 1.21A 5dzkf-3hf1A:
undetectable
5dzkt-3hf1A:
undetectable		 5dzkf-3hf1A:
20.51
5dzkt-3hf1A:
5.71
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.
3hzn OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE

(Salmonella
enterica) 		PF00881
(Nitroreductase) 		4 SER A  79
ALA A  78
HIS A  80
LEU A 159
 None
None
TLA  A 218 (-4.0A)
None
 1.38A 5dzkf-3hznA:
undetectable
5dzkt-3hznA:
undetectable		 5dzkf-3hznA:
22.18
5dzkt-3hznA:
1.29
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.
3ocr CLASS II
ALDOLASE/ADDUCIN
DOMAIN PROTEIN

(Pseudomonas
savastanoi) 		PF00596
(Aldolase_II) 		4 SER A  57
ALA A  58
HIS A 110
LEU A 124
 None
 1.36A 5dzkf-3ocrA:
undetectable
5dzkt-3ocrA:
undetectable		 5dzkf-3ocrA:
22.76
5dzkt-3ocrA:
1.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3q7h ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT

(Coxiella
burnetii) 		PF00574
(CLP_protease) 		4 SER A  99
ALA A 102
HIS A 124
LEU A 151
 None
 1.44A 5dzkf-3q7hA:
27.0
5dzkt-3q7hA:
undetectable		 5dzkf-3q7hA:
47.12
5dzkt-3q7hA:
1.92
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.
3qw4 UMP SYNTHASE

(Leishmania
donovani) 		PF00156
(Pribosyltran)
PF00215
(OMPdecase) 		4 SER B 331
ALA B 330
MET B 300
LEU B 327
 None
 1.39A 5dzkf-3qw4B:
undetectable
5dzkt-3qw4B:
undetectable		 5dzkf-3qw4B:
19.91
5dzkt-3qw4B:
25.00
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.
3rac HISTIDINE-TRNA
LIGASE

(Alicyclobacillus
acidocaldarius) 		PF13393
(tRNA-synt_His) 		4 SER A 171
ALA A 170
HIS A 179
LEU A 167
 None
 1.20A 5dzkf-3racA:
undetectable
5dzkt-3racA:
undetectable		 5dzkf-3racA:
20.38
5dzkt-3racA:
4.17
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.
3s4w FANCONI ANEMIA GROUP
D2 PROTEIN HOMOLOG

(Mus musculus) 		PF14631
(FancD2) 		4 ALA B 576
HIS B 554
MET B 583
LEU B 614
 None
 1.44A 5dzkf-3s4wB:
2.7
5dzkt-3s4wB:
undetectable		 5dzkf-3s4wB:
9.61
5dzkt-3s4wB:
11.11
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.
3trc PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Coxiella
burnetii) 		PF01590
(GAF) 		4 SER A 134
ALA A  90
HIS A 110
LEU A  94
 None
 1.09A 5dzkf-3trcA:
undetectable
5dzkt-3trcA:
undetectable		 5dzkf-3trcA:
23.89
5dzkt-3trcA:
1.17
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.
4ad8 DNA REPAIR PROTEIN
RECN

(Deinococcus
radiodurans) 		PF02463
(SMC_N) 		4 SER A 150
ALA A 151
HIS A 146
LEU A 450
 None
 1.40A 5dzkf-4ad8A:
undetectable
5dzkt-4ad8A:
undetectable		 5dzkf-4ad8A:
18.58
5dzkt-4ad8A:
2.41
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.
4g56 MGC81050 PROTEIN

(Xenopus laevis) 		PF00400
(WD40) 		4 SER B 263
ALA B 262
HIS B 244
LEU B 273
 None
 1.25A 5dzkf-4g56B:
undetectable
5dzkt-4g56B:
undetectable		 5dzkf-4g56B:
21.88
5dzkt-4g56B:
3.51
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.
4h17 HYDROLASE,
ISOCHORISMATASE
FAMILY

(Pseudomonas
putida) 		PF00857
(Isochorismatase) 		4 SER A 157
ALA A 156
HIS A 175
LEU A 152
 None
None
EDO  A 206 ( 4.1A)
None
 1.05A 5dzkf-4h17A:
undetectable
5dzkt-4h17A:
undetectable		 5dzkf-4h17A:
24.27
5dzkt-4h17A:
3.57
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.
4rlv ANKYRIN-1, ANKYRIN-2

(Homo sapiens;
Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4)
PF13857
(Ank_5) 		4 SER A2274
ALA A2273
MET A1607
LEU A2270
 None
 1.03A 5dzkf-4rlvA:
undetectable
5dzkt-4rlvA:
undetectable		 5dzkf-4rlvA:
13.96
5dzkt-4rlvA:
1.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4u0g ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2

(Mycobacterium
tuberculosis) 		PF00574
(CLP_protease) 		4 SER A 110
ALA A 111
HIS A 135
MET A 164
 ZIL  A 301 ( 4.0A)
ZIL  A 301 ( 4.0A)
ZIL  A 301 (-3.7A)
ZIL  A 301 ( 2.9A)
 0.42A 5dzkf-4u0gA:
27.4
5dzkt-4u0gA:
undetectable		 5dzkf-4u0gA:
100.00
5dzkt-4u0gA:
1.92
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.
4u9o NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT A

(Vibrio cholerae) 		PF05896
(NQRA)
PF11973
(NQRA_SLBB) 		4 SER A 300
ALA A 309
HIS A 320
LEU A  32
 None
 1.32A 5dzkf-4u9oA:
undetectable
5dzkt-4u9oA:
undetectable		 5dzkf-4u9oA:
22.04
5dzkt-4u9oA:
5.71
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.
4uvj COHESIN SUBUNIT SCC3

(Saccharomyces
cerevisiae) 		no annotation 4 SER A 692
ALA A 691
MET A 746
LEU A 688
 None
 0.82A 5dzkf-4uvjA:
undetectable
5dzkt-4uvjA:
undetectable		 5dzkf-4uvjA:
20.15
5dzkt-4uvjA:
12.50
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.
4wy8 ESTERASE

(Rhizomucor
miehei) 		PF07859
(Abhydrolase_3) 		4 SER A 164
ALA A 165
HIS A 291
MET A 218
 None
 1.20A 5dzkf-4wy8A:
2.3
5dzkt-4wy8A:
undetectable		 5dzkf-4wy8A:
22.94
5dzkt-4wy8A:
4.44
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.
4wyi MONOGALACTOSYLDIACYL
GLYCEROL SYNTHASE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF04101
(Glyco_tran_28_C)
PF06925
(MGDG_synth) 		4 SER A 158
ALA A 159
HIS A 155
MET A 148
 None
 1.46A 5dzkf-4wyiA:
2.6
5dzkt-4wyiA:
undetectable		 5dzkf-4wyiA:
20.99
5dzkt-4wyiA:
1.52
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.
4wyi MONOGALACTOSYLDIACYL
GLYCEROL SYNTHASE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF04101
(Glyco_tran_28_C)
PF06925
(MGDG_synth) 		4 SER A 158
ALA A 161
HIS A 155
LEU A 321
 None
 1.38A 5dzkf-4wyiA:
2.6
5dzkt-4wyiA:
undetectable		 5dzkf-4wyiA:
20.99
5dzkt-4wyiA:
1.52
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.
4ypv EST8

(Parvibaculum) 		PF07859
(Abhydrolase_3) 		4 SER A 159
ALA A 160
HIS A 283
MET A 213
 None
 1.22A 5dzkf-4ypvA:
2.6
5dzkt-4ypvA:
undetectable		 5dzkf-4ypvA:
22.35
5dzkt-4ypvA:
4.17
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.
4yzo PUTATIVE ACYL-COA
ACYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 SER A  76
ALA A 358
HIS A 320
LEU A 131
 None
 1.38A 5dzkf-4yzoA:
undetectable
5dzkt-4yzoA:
undetectable		 5dzkf-4yzoA:
19.79
5dzkt-4yzoA:
6.45
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.
4zgf UNCHARACTERIZED
PROTEIN

(Bacteroides
vulgatus) 		PF16139
(DUF4847) 		4 SER A  31
ALA A  30
HIS A 160
LEU A 145
 None
None
P6G  A 205 ( 3.9A)
None
 1.40A 5dzkf-4zgfA:
undetectable
5dzkt-4zgfA:
undetectable		 5dzkf-4zgfA:
21.89
5dzkt-4zgfA:
1.63
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.
5b3n ANTI-H4K20ME1_SCFV

(Mus musculus) 		PF07686
(V-set) 		4 SER A  37
ALA A  51
HIS A 101
LEU A 238
 None
 1.32A 5dzkf-5b3nA:
undetectable
5dzkt-5b3nA:
undetectable		 5dzkf-5b3nA:
22.42
5dzkt-5b3nA:
1.04
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.
5bu6 BPSB (PGAB),
POLY-BETA-1,6-N-ACET
YL-D-GLUCOSAMINE
N-DEACETYLASE

(Bordetella
bronchiseptica) 		PF01522
(Polysacc_deac_1) 		4 ALA A  57
HIS A 189
MET A  62
LEU A  55
 None
NI  A 401 ( 3.3A)
None
None
 1.47A 5dzkf-5bu6A:
undetectable
5dzkt-5bu6A:
undetectable		 5dzkf-5bu6A:
22.22
5dzkt-5bu6A:
2.50
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.
5ck7 ADP-DEPENDENT
GLUCOKINASE

(Mus musculus) 		PF04587
(ADP_PFK_GK) 		4 SER A 320
ALA A 319
HIS A 295
LEU A 257
 None
 1.37A 5dzkf-5ck7A:
undetectable
5dzkt-5ck7A:
undetectable		 5dzkf-5ck7A:
20.42
5dzkt-5ck7A:
3.57
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.
5d88 PREDICTED PROTEASE
OF THE COLLAGENASE
FAMILY

(Methanopyrus
kandleri) 		PF01136
(Peptidase_U32) 		4 SER A 120
ALA A 101
HIS A 121
LEU A  63
 None
None
ACT  A 302 (-3.9A)
None
 1.40A 5dzkf-5d88A:
2.4
5dzkt-5d88A:
undetectable		 5dzkf-5d88A:
22.18
5dzkt-5d88A:
3.51
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.
5d8m METAGENOMIC CARBOXYL
ESTERASE MGS0156

(uncultured
organism) 		no annotation 4 SER A 232
ALA A 261
HIS A 231
LEU A 352
 None
 0.91A 5dzkf-5d8mA:
2.3
5dzkt-5d8mA:
undetectable		 5dzkf-5d8mA:
22.62
5dzkt-5d8mA:
2.08
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.
5elp NRPS/PKS PROTEIN

(Bacillus
amyloliquefaciens) 		no annotation 4 SER C 420
ALA C 316
HIS C 430
LEU C 332
 None
 1.40A 5dzkf-5elpC:
undetectable
5dzkt-5elpC:
undetectable		 5dzkf-5elpC:
15.27
5dzkt-5elpC:
1.71
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.
5hjl TAGATOSE
1,6-DIPHOSPHATE
ALDOLASE

(Streptococcus
porcinus) 		PF01791
(DeoC) 		4 SER A 240
ALA A 239
HIS A 241
LEU A 203
 None
 1.40A 5dzkf-5hjlA:
1.9
5dzkt-5hjlA:
undetectable		 5dzkf-5hjlA:
22.80
5dzkt-5hjlA:
2.94
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.
5iz5 CYTOSOLIC
PHOSPHOLIPASE A2
DELTA

(Homo sapiens) 		no annotation 4 SER B 337
ALA B 334
HIS B 341
LEU B 732
 None
 1.15A 5dzkf-5iz5B:
undetectable
5dzkt-5iz5B:
undetectable		 5dzkf-5iz5B:
13.54
5dzkt-5iz5B:
4.55
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.
5j7z PUTATIVE SECRETED
ENDOGLYCOSYLCERAMIDA
SE

(Rhodococcus
hoagii) 		PF00150
(Cellulase) 		4 ALA A 355
HIS A  54
MET A 399
LEU A 352
 None
 1.45A 5dzkf-5j7zA:
2.5
5dzkt-5j7zA:
undetectable		 5dzkf-5j7zA:
18.38
5dzkt-5j7zA:
3.28
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.
5k7v DESIGNED PROTEIN
HR00C3

(synthetic
construct) 		no annotation 4 SER A 183
ALA A 182
MET A 129
LEU A 180
 None
 1.05A 5dzkf-5k7vA:
undetectable
5dzkt-5k7vA:
undetectable		 5dzkf-5k7vA:
23.15
5dzkt-5k7vA:
1.17
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.
5m49 AMINOTRANSFERASE
CLASS-III

(Rhizobium
freirei) 		PF00202
(Aminotran_3) 		4 SER A  95
ALA A  94
HIS A 251
LEU A 310
 None
 1.41A 5dzkf-5m49A:
undetectable
5dzkt-5m49A:
undetectable		 5dzkf-5m49A:
20.95
5dzkt-5m49A:
1.21
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.
5mal LIPASE

(Streptomyces
rimosus) 		PF13472
(Lipase_GDSL_2) 		4 SER A  41
ALA A  40
HIS A  42
LEU A 227
 None
 1.01A 5dzkf-5malA:
2.3
5dzkt-5malA:
undetectable		 5dzkf-5malA:
23.20
5dzkt-5malA:
1.72
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.
5mrw POTASSIUM-TRANSPORTI
NG ATPASE
ATP-BINDING SUBUNIT

(Escherichia
coli) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		4 SER B 619
ALA B 616
MET B 608
LEU B 676
 None
 1.45A 5dzkf-5mrwB:
undetectable
5dzkt-5mrwB:
undetectable		 5dzkf-5mrwB:
16.36
5dzkt-5mrwB:
5.41
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.
5vhi 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 2

(Homo sapiens) 		PF00004
(AAA) 		4 SER f 409
ALA f 410
MET f 416
LEU f 372
 None
 1.28A 5dzkf-5vhif:
undetectable
5dzkt-5vhif:
undetectable		 5dzkf-5vhif:
13.63
5dzkt-5vhif:
1.11
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.
5w76 ANCESTRAL ELOGATION
FACTOR N153

(synthetic
construct) 		no annotation 4 ALA A 123
HIS A 119
MET A  92
LEU A 104
 None
 1.49A 5dzkf-5w76A:
undetectable
5dzkt-5w76A:
undetectable		 5dzkf-5w76A:
undetectable
5dzkt-5w76A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y4d ANKYRIN-1,ANKYRIN-2,
ANKYRIN-2

(Homo sapiens;
Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4) 		4 SER A2274
ALA A2273
MET A1615
LEU A2270
 None
 1.04A 5dzkf-5y4dA:
undetectable
5dzkt-5y4dA:
undetectable		 5dzkf-5y4dA:
14.73
5dzkt-5y4dA:
1.64
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.
6bgi ANOCTAMIN-1

(Mus musculus) 		no annotation 4 SER A 401
ALA A 400
HIS A 402
LEU A 630
 None
 1.38A 5dzkf-6bgiA:
undetectable
5dzkt-6bgiA:
undetectable		 5dzkf-6bgiA:
undetectable
5dzkt-6bgiA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6eic MYCOBACTERIUM
TUBERCULOSIS
MONOGLYCERIDE LIPASE

(Mycobacterium
tuberculosis) 		no annotation 4 SER C 110
ALA C 136
HIS C 109
LEU C 228
 MPD  C 302 (-3.3A)
SO4  C 301 ( 4.0A)
MPD  C 302 (-4.3A)
SO4  C 301 ( 4.4A)
 0.97A 5dzkf-6eicC:
3.4
5dzkt-6eicC:
undetectable		 5dzkf-6eicC:
undetectable
5dzkt-6eicC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f2d FLAGELLAR
BIOSYNTHETIC PROTEIN
FLIP
FLAGELLAR
BIOSYNTHETIC PROTEIN
FLIR

(Salmonella
enterica;
Salmonella
enterica) 		no annotation
no annotation 		4 SER F  34
HIS F 143
MET F 134
LEU A 179
 None
 1.07A 5dzkf-6f2dF:
undetectable
5dzkt-6f2dF:
undetectable		 5dzkf-6f2dF:
undetectable
5dzkt-6f2dF:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ffl MALTOSE/MALTODEXTRIN
TRANSPORT PERMEASE
HOMOLOGUE

(Bdellovibrio
bacteriovorus) 		no annotation 4 SER A 331
ALA A 332
HIS A 115
LEU A 310
 None
 1.31A 5dzkf-6fflA:
undetectable
5dzkt-6fflA:
undetectable		 5dzkf-6fflA:
undetectable
5dzkt-6fflA:
undetectable