SIMILAR PATTERNS OF AMINO ACIDS FOR 6CDU_F_EY4F500

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.
1akm ORNITHINE
TRANSCARBAMYLASE

(Escherichia
coli) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 ALA A 117
THR A 115
ILE A  50
GLN A 104
VAL A 124
 None
 1.45A 6cduF-1akmA:
undetectable
6cduJ-1akmA:
0.0		 6cduF-1akmA:
20.58
6cduJ-1akmA:
20.58
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.
1b8h DNA POLYMERASE
PROCESSIVITY
COMPONENT

(Escherichia
virus RB69) 		PF02916
(DNA_PPF)
PF09116
(gp45-slide_C) 		4 ALA A  40
THR A  31
GLN A 213
VAL A 214
 None
 0.90A 6cduF-1b8hA:
undetectable
6cduJ-1b8hA:
0.0		 6cduF-1b8hA:
21.39
6cduJ-1b8hA:
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.
1cd1 CD1

(Mus musculus) 		PF07654
(C1-set)
PF16497
(MHC_I_3) 		4 THR A 135
ILE A  98
GLN A  99
VAL A 118
 None
 0.92A 6cduF-1cd1A:
3.1
6cduJ-1cd1A:
3.0		 6cduF-1cd1A:
19.65
6cduJ-1cd1A:
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.
1cj2 PROTEIN
(P-HYDROXYBENZOATE
HYDROXYLASE)

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		4 ALA A 156
ILE A  26
GLN A   4
VAL A   5
 None
 0.96A 6cduF-1cj2A:
undetectable
6cduJ-1cj2A:
undetectable		 6cduF-1cj2A:
22.52
6cduJ-1cj2A:
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.
1dnv GALLERIA MELLONELLA
DENSOVIRUS CAPSID
PROTEIN

(Lepidopteran
ambidensovirus
1) 		PF02336
(Denso_VP4) 		4 ALA A 195
THR A 194
ILE A 182
GLN A  87
 None
 0.71A 6cduF-1dnvA:
0.0
6cduJ-1dnvA:
0.0		 6cduF-1dnvA:
22.64
6cduJ-1dnvA:
22.64
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.
1e4o MALTODEXTRIN
PHOSPHORYLASE

(Escherichia
coli) 		PF00343
(Phosphorylase) 		4 ALA A 127
THR A 128
ILE A  70
VAL A 206
 None
 0.96A 6cduF-1e4oA:
0.0
6cduJ-1e4oA:
0.0		 6cduF-1e4oA:
18.06
6cduJ-1e4oA:
18.06
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.
1fnf FIBRONECTIN

(Homo sapiens) 		PF00041
(fn3) 		4 ALA A1428
THR A1429
ILE A1485
VAL A1425
 None
 0.96A 6cduF-1fnfA:
2.0
6cduJ-1fnfA:
1.7		 6cduF-1fnfA:
24.34
6cduJ-1fnfA:
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.
1h9m MOLYBDENUM-BINDING-P
ROTEIN

(Azotobacter
vinelandii) 		PF03459
(TOBE) 		4 ALA A 127
THR A  68
ILE A  88
VAL A  85
 None
 0.94A 6cduF-1h9mA:
0.0
6cduJ-1h9mA:
0.0		 6cduF-1h9mA:
17.85
6cduJ-1h9mA:
17.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hp1 5'-NUCLEOTIDASE

(Escherichia
coli) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		4 ALA A 215
ILE A 165
VAL A 167
PRO A 209
 None
 0.89A 6cduF-1hp1A:
undetectable
6cduJ-1hp1A:
0.0		 6cduF-1hp1A:
22.20
6cduJ-1hp1A:
22.20
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.
1jq4 METHANE
MONOOXYGENASE
COMPONENT C

(Methylococcus
capsulatus) 		PF00111
(Fer2) 		4 ALA A  30
THR A  29
ILE A  92
PRO A  95
 None
 0.91A 6cduF-1jq4A:
undetectable
6cduJ-1jq4A:
undetectable		 6cduF-1jq4A:
14.15
6cduJ-1jq4A:
14.15
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.
1k25 LOW-AFFINITY
PENICILLIN-BINDING
PROTEIN 2X

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF03793
(PASTA) 		4 ALA A 707
THR A 706
GLN A 728
VAL A 727
 None
 0.94A 6cduF-1k25A:
undetectable
6cduJ-1k25A:
undetectable		 6cduF-1k25A:
18.31
6cduJ-1k25A:
18.31
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.
1kk0 EIF2GAMMA

(Pyrococcus
abyssi) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF09173
(eIF2_C) 		4 ALA A  55
THR A  31
ILE A 198
VAL A  85
 None
 0.96A 6cduF-1kk0A:
undetectable
6cduJ-1kk0A:
undetectable		 6cduF-1kk0A:
21.28
6cduJ-1kk0A:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lns X-PROLYL DIPEPTIDYL
AMINOPEPTIDASE

(Lactococcus
lactis) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C)
PF09168
(PepX_N) 		4 ALA A 358
THR A 359
ILE A 462
VAL A 460
 None
 0.92A 6cduF-1lnsA:
undetectable
6cduJ-1lnsA:
undetectable		 6cduF-1lnsA:
17.91
6cduJ-1lnsA:
17.91
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.
1p4m RIBOFLAVIN KINASE

(Homo sapiens) 		PF01687
(Flavokinase) 		5 ALA A  35
THR A  87
ILE A 101
GLN A  18
VAL A  19
 ADP  A 301 ( 4.0A)
None
None
None
ADP  A 301 (-4.7A)
 1.14A 6cduF-1p4mA:
undetectable
6cduJ-1p4mA:
undetectable		 6cduF-1p4mA:
18.09
6cduJ-1p4mA:
18.09
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.
1q90 APOCYTOCHROME F
CYTOCHROME B6F
COMPLEX SUBUNIT PETN

(Chlamydomonas
reinhardtii;
Chlamydomonas
reinhardtii) 		PF01333
(Apocytochr_F_C)
PF16639
(Apocytochr_F_N)
PF03742
(PetN) 		4 ALA N  79
THR N  80
ILE N  72
GLN A 253
 None
 0.96A 6cduF-1q90N:
undetectable
6cduJ-1q90N:
undetectable		 6cduF-1q90N:
6.67
6cduJ-1q90N:
6.67
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.
1rzr GLUCOSE-RESISTANCE
AMYLASE REGULATOR

(Bacillus
megaterium) 		no annotation 4 ALA G  86
THR G  87
ILE G  94
VAL G  63
 None
 0.93A 6cduF-1rzrG:
undetectable
6cduJ-1rzrG:
undetectable		 6cduF-1rzrG:
22.10
6cduJ-1rzrG:
22.10
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.
1sq5 PANTOTHENATE KINASE

(Escherichia
coli) 		PF00485
(PRK) 		5 THR A1125
ILE A1290
GLN A1205
VAL A1203
PRO A1148
 None
 1.33A 6cduF-1sq5A:
undetectable
6cduJ-1sq5A:
undetectable		 6cduF-1sq5A:
21.85
6cduJ-1sq5A:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sva SIMIAN VIRUS 40

(Macaca mulatta
polyomavirus 1) 		PF00718
(Polyoma_coat) 		4 ALA 1 263
ILE 1 288
VAL 1 261
PRO 1 252
 None
 0.90A 6cduF-1sva1:
undetectable
6cduJ-1sva1:
undetectable		 6cduF-1sva1:
21.35
6cduJ-1sva1:
21.35
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.
1tt7 YHFP

(Bacillus
subtilis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 ALA A 159
THR A 160
VAL A 168
PRO A 294
 None
 0.93A 6cduF-1tt7A:
undetectable
6cduJ-1tt7A:
undetectable		 6cduF-1tt7A:
23.81
6cduJ-1tt7A:
23.81
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.
1w25 STALKED-CELL
DIFFERENTIATION
CONTROLLING PROTEIN

(Caulobacter
vibrioides) 		PF00072
(Response_reg)
PF00990
(GGDEF) 		4 ALA A 314
THR A 315
ILE A 375
VAL A 321
 None
 0.93A 6cduF-1w25A:
3.2
6cduJ-1w25A:
3.2		 6cduF-1w25A:
21.94
6cduJ-1w25A:
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		4 ALA A 175
THR A 176
GLN A 115
VAL A 117
 None
 0.91A 6cduF-1w8oA:
undetectable
6cduJ-1w8oA:
2.6		 6cduF-1w8oA:
21.89
6cduJ-1w8oA:
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.
1yz4 DUAL SPECIFICITY
PHOSPHATASE-LIKE 15
ISOFORM A

(Homo sapiens) 		PF00782
(DSPc) 		4 THR A 105
ILE A 118
VAL A 114
PRO A 127
 None
 0.94A 6cduF-1yz4A:
undetectable
6cduJ-1yz4A:
undetectable		 6cduF-1yz4A:
19.12
6cduJ-1yz4A:
19.12
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.
1yzv HYPOTHETICAL PROTEIN

(Trypanosoma
cruzi) 		PF00857
(Isochorismatase) 		4 ALA A 133
THR A 164
GLN A 104
VAL A 106
 None
 0.95A 6cduF-1yzvA:
undetectable
6cduJ-1yzvA:
undetectable		 6cduF-1yzvA:
21.36
6cduJ-1yzvA:
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.
1z47 PUTATIVE
ABC-TRANSPORTER
ATP-BINDING PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF00005
(ABC_tran)
PF08402
(TOBE_2) 		4 ALA A 301
THR A 319
GLN A 292
VAL A 343
 None
 0.96A 6cduF-1z47A:
undetectable
6cduJ-1z47A:
undetectable		 6cduF-1z47A:
22.48
6cduJ-1z47A:
22.48
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.
2axc COLICIN E7

(Escherichia
coli) 		PF03515
(Cloacin) 		4 ALA A 254
ILE A 191
GLN A 189
VAL A 183
 None
 0.86A 6cduF-2axcA:
undetectable
6cduJ-2axcA:
undetectable		 6cduF-2axcA:
20.53
6cduJ-2axcA:
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.
2b0h TALIN-1

(Mus musculus) 		PF08913
(VBS) 		4 ALA A1861
THR A1860
ILE A1916
VAL A1964
 None
 0.94A 6cduF-2b0hA:
6.6
6cduJ-2b0hA:
6.5		 6cduF-2b0hA:
19.62
6cduJ-2b0hA:
19.62
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.
2bas YKUI PROTEIN

(Bacillus
subtilis) 		PF00563
(EAL)
PF10388
(YkuI_C) 		5 ALA A 302
THR A 306
ILE A 334
GLN A 336
VAL A 326
 None
 1.23A 6cduF-2basA:
undetectable
6cduJ-2basA:
undetectable		 6cduF-2basA:
21.62
6cduJ-2basA:
21.62
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.
2csu 457AA LONG
HYPOTHETICAL PROTEIN

(Pyrococcus
horikoshii) 		PF13380
(CoA_binding_2)
PF13607
(Succ_CoA_lig) 		4 ALA A 207
ILE A 174
VAL A 152
PRO A 429
 None
 0.92A 6cduF-2csuA:
undetectable
6cduJ-2csuA:
undetectable		 6cduF-2csuA:
22.27
6cduJ-2csuA:
22.27
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.
2drh 361AA LONG
HYPOTHETICAL
D-AMINOPEPTIDASE

(Pyrococcus
horikoshii) 		PF03576
(Peptidase_S58) 		4 ALA A 314
THR A 315
ILE A 194
VAL A 192
 None
 0.88A 6cduF-2drhA:
undetectable
6cduJ-2drhA:
undetectable		 6cduF-2drhA:
22.25
6cduJ-2drhA:
22.25
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.
2dtc RAL GUANINE
NUCLEOTIDE EXCHANGE
FACTOR RALGPS1A

(Mus musculus) 		PF00169
(PH) 		4 ALA A  34
THR A  35
VAL A  63
TRP A  65
 None
 0.87A 6cduF-2dtcA:
undetectable
6cduJ-2dtcA:
undetectable		 6cduF-2dtcA:
17.24
6cduJ-2dtcA:
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.
2f51 THIOREDOXIN

(Trichomonas
vaginalis) 		PF00085
(Thioredoxin) 		4 ALA A  68
THR A  11
ILE A  58
VAL A  60
 None
 0.86A 6cduF-2f51A:
undetectable
6cduJ-2f51A:
undetectable		 6cduF-2f51A:
16.00
6cduJ-2f51A:
16.00
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.
2fo1 LIN-12 PROTEIN

(Caenorhabditis
elegans) 		PF00023
(Ank)
PF12796
(Ank_2) 		4 ALA E1030
ILE E1048
VAL E1056
TRP E1059
 None
 0.80A 6cduF-2fo1E:
undetectable
6cduJ-2fo1E:
undetectable		 6cduF-2fo1E:
22.58
6cduJ-2fo1E:
22.58
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.
2g0b FEEM

(uncultured
bacterium) 		no annotation 5 ALA A 129
THR A 127
GLN A 183
VAL A 177
TRP A 180
 None
 1.41A 6cduF-2g0bA:
undetectable
6cduJ-2g0bA:
undetectable		 6cduF-2g0bA:
20.61
6cduJ-2g0bA:
20.61
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.
2hms YUAA PROTEIN

(Bacillus
subtilis) 		PF02254
(TrkA_N) 		4 ALA A  49
THR A  50
ILE A  75
VAL A  22
 None
 0.80A 6cduF-2hmsA:
undetectable
6cduJ-2hmsA:
undetectable		 6cduF-2hmsA:
16.98
6cduJ-2hmsA:
16.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jg5 FRUCTOSE 1-PHOSPHATE
KINASE

(Staphylococcus
aureus) 		PF00294
(PfkB) 		4 ALA A 234
ILE A 294
GLN A 297
VAL A 298
 None
 0.68A 6cduF-2jg5A:
undetectable
6cduJ-2jg5A:
undetectable		 6cduF-2jg5A:
22.73
6cduJ-2jg5A:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jty TYPE-1 FIMBRIAL
PROTEIN, A CHAIN

(Escherichia
coli) 		PF00419
(Fimbrial) 		4 ALA A 150
ILE A 103
GLN A 102
VAL A 101
 None
 0.91A 6cduF-2jtyA:
undetectable
6cduJ-2jtyA:
undetectable		 6cduF-2jtyA:
18.79
6cduJ-2jtyA:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nnz HYPOTHETICAL PROTEIN

(Archaeoglobus
fulgidus) 		PF04126
(Cyclophil_like) 		4 ALA A  34
ILE A  41
GLN A  57
VAL A  58
 None
 0.95A 6cduF-2nnzA:
undetectable
6cduJ-2nnzA:
undetectable		 6cduF-2nnzA:
17.63
6cduJ-2nnzA:
17.63
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.
2nzu CATABOLITE CONTROL
PROTEIN

(Bacillus
megaterium) 		PF13377
(Peripla_BP_3) 		4 ALA G  86
THR G  87
ILE G  94
VAL G  63
 None
 0.86A 6cduF-2nzuG:
undetectable
6cduJ-2nzuG:
undetectable		 6cduF-2nzuG:
20.76
6cduJ-2nzuG:
20.76
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.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		4 ALA A 188
THR A 187
ILE A 256
VAL A 174
 None
 0.77A 6cduF-2okcA:
undetectable
6cduJ-2okcA:
undetectable		 6cduF-2okcA:
19.91
6cduJ-2okcA:
19.91
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.
2oys HYPOTHETICAL PROTEIN
SP1951

(Streptococcus
pneumoniae) 		PF03358
(FMN_red) 		4 ALA A 169
THR A 170
ILE A 154
VAL A 152
 None
 0.94A 6cduF-2oysA:
undetectable
6cduJ-2oysA:
undetectable		 6cduF-2oysA:
22.62
6cduJ-2oysA:
22.62
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.
2pyh POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 4

(Azotobacter
vinelandii) 		PF12708
(Pectate_lyase_3) 		4 ALA A 280
THR A 257
ILE A 285
VAL A 277
 None
 0.89A 6cduF-2pyhA:
undetectable
6cduJ-2pyhA:
undetectable		 6cduF-2pyhA:
21.09
6cduJ-2pyhA:
21.09
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.
2waa XYLAN ESTERASE,
PUTATIVE, AXE2C

(Cellvibrio
japonicus) 		PF13472
(Lipase_GDSL_2) 		5 ALA A 232
THR A 271
ILE A 135
VAL A 137
PRO A 226
 None
 1.35A 6cduF-2waaA:
undetectable
6cduJ-2waaA:
undetectable		 6cduF-2waaA:
19.45
6cduJ-2waaA:
19.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yxm MYOSIN-BINDING
PROTEIN C, SLOW-TYPE

(Homo sapiens) 		PF07679
(I-set) 		4 THR A  89
ILE A  64
GLN A  62
VAL A  30
 None
 0.79A 6cduF-2yxmA:
1.9
6cduJ-2yxmA:
undetectable		 6cduF-2yxmA:
14.80
6cduJ-2yxmA:
14.80
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.
2zc4 PENICILLIN-BINDING
PROTEIN 2X

(Streptococcus
pneumoniae) 		PF03793
(PASTA) 		4 ALA C 707
THR C 706
GLN C 728
VAL C 727
 None
 0.92A 6cduF-2zc4C:
undetectable
6cduJ-2zc4C:
undetectable		 6cduF-2zc4C:
17.85
6cduJ-2zc4C:
17.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zf5 GLYCEROL KINASE

(Thermococcus
kodakarensis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 ALA O 372
THR O 373
ILE O 360
VAL O 335
 None
 0.91A 6cduF-2zf5O:
undetectable
6cduJ-2zf5O:
undetectable		 6cduF-2zf5O:
22.09
6cduJ-2zf5O:
22.09
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.
3ak4 NADH-DEPENDENT
QUINUCLIDINONE
REDUCTASE

(Agrobacterium
tumefaciens) 		PF13561
(adh_short_C2) 		4 ALA A  39
THR A  15
ILE A  78
GLN A  75
 None
 0.95A 6cduF-3ak4A:
undetectable
6cduJ-3ak4A:
undetectable		 6cduF-3ak4A:
21.26
6cduJ-3ak4A:
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.
3bjb PROBABLE
TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY PROTEIN

(Rhodococcus
jostii) 		PF00440
(TetR_N) 		4 ALA A  33
THR A  34
ILE A 119
GLN A 120
 None
 0.86A 6cduF-3bjbA:
3.6
6cduJ-3bjbA:
3.3		 6cduF-3bjbA:
20.87
6cduJ-3bjbA:
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.
3dec BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		4 ALA A 804
THR A 803
ILE A 760
VAL A 806
 None
 0.92A 6cduF-3decA:
2.0
6cduJ-3decA:
1.7		 6cduF-3decA:
15.78
6cduJ-3decA:
15.78
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.
3e49 UNCHARACTERIZED
PROTEIN DUF849 WITH
A TIM BARREL FOLD

(Paraburkholderia
xenovorans) 		PF05853
(BKACE) 		5 ALA A 220
THR A 219
GLN A 197
VAL A 196
TRP A 230
 None
 1.41A 6cduF-3e49A:
undetectable
6cduJ-3e49A:
undetectable		 6cduF-3e49A:
23.36
6cduJ-3e49A:
23.36
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.
3e9n PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Corynebacterium
glutamicum) 		PF00106
(adh_short) 		4 ALA A  11
THR A  12
ILE A  45
VAL A  20
 None
 0.94A 6cduF-3e9nA:
undetectable
6cduJ-3e9nA:
undetectable		 6cduF-3e9nA:
18.77
6cduJ-3e9nA:
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.
3ec7 PUTATIVE
DEHYDROGENASE

(Salmonella
enterica) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ALA A  74
THR A  73
ILE A  62
VAL A  82
 NAD  A 400 (-3.8A)
None
None
None
 0.90A 6cduF-3ec7A:
undetectable
6cduJ-3ec7A:
undetectable		 6cduF-3ec7A:
20.53
6cduJ-3ec7A:
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.
3eq1 PORPHOBILINOGEN
DEAMINASE

(Homo sapiens) 		PF01379
(Porphobil_deam)
PF03900
(Porphobil_deamC) 		4 ALA A 297
THR A 298
ILE A 248
GLN A 332
 None
 0.93A 6cduF-3eq1A:
undetectable
6cduJ-3eq1A:
undetectable		 6cduF-3eq1A:
23.28
6cduJ-3eq1A:
23.28
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.
3fsn RETINAL PIGMENT
EPITHELIUM-SPECIFIC
65 KDA PROTEIN

(Bos taurus) 		PF03055
(RPE65) 		4 ALA A 177
THR A 178
ILE A 225
VAL A 174
 None
 0.80A 6cduF-3fsnA:
undetectable
6cduJ-3fsnA:
undetectable		 6cduF-3fsnA:
19.67
6cduJ-3fsnA:
19.67
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.
3fw6 CELLULASE

(uncultured
bacterium) 		PF12891
(Glyco_hydro_44) 		5 ALA A 409
THR A 407
GLN A 512
VAL A 541
PRO A 537
 None
 1.37A 6cduF-3fw6A:
undetectable
6cduJ-3fw6A:
undetectable		 6cduF-3fw6A:
22.84
6cduJ-3fw6A:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g5l PUTATIVE
S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE

(Listeria
monocytogenes) 		PF13649
(Methyltransf_25) 		4 ALA A 150
THR A 149
VAL A 169
TRP A 167
 None
 0.86A 6cduF-3g5lA:
undetectable
6cduJ-3g5lA:
undetectable		 6cduF-3g5lA:
18.98
6cduJ-3g5lA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3go7 RIBOKINASE RBSK

(Mycobacterium
tuberculosis) 		PF00294
(PfkB) 		4 ALA A 276
THR A 277
GLN A  56
VAL A 243
 None
 0.86A 6cduF-3go7A:
undetectable
6cduJ-3go7A:
undetectable		 6cduF-3go7A:
21.45
6cduJ-3go7A:
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.
3gyb TRANSCRIPTIONAL
REGULATORS
(LACI-FAMILY
TRANSCRIPTIONAL
REGULATORY PROTEIN)

(Corynebacterium
glutamicum) 		PF13377
(Peripla_BP_3) 		4 ALA A 125
ILE A  66
VAL A  68
PRO A 119
 None
 0.90A 6cduF-3gybA:
undetectable
6cduJ-3gybA:
undetectable		 6cduF-3gybA:
21.66
6cduJ-3gybA:
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.
3gzg MOLYBDATE-BINDING
PERIPLASMIC PROTEIN
PERMEASE

(Xanthomonas
citri) 		PF13531
(SBP_bac_11) 		4 ALA A 174
ILE A 168
VAL A  88
PRO A  99
 None
 0.72A 6cduF-3gzgA:
undetectable
6cduJ-3gzgA:
undetectable		 6cduF-3gzgA:
19.35
6cduJ-3gzgA:
19.35
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.
3ilk UNCHARACTERIZED
TRNA/RRNA
METHYLTRANSFERASE
HI0380

(Haemophilus
influenzae) 		PF00588
(SpoU_methylase) 		5 ALA A  24
THR A  27
ILE A 108
VAL A 146
PRO A  92
 None
 1.40A 6cduF-3ilkA:
undetectable
6cduJ-3ilkA:
undetectable		 6cduF-3ilkA:
22.16
6cduJ-3ilkA:
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.
3j23 CAPSID PROTEIN VP1
CAPSID PROTEIN VP3

(Enterovirus A;
Enterovirus A) 		PF00073
(Rhv)
PF00073
(Rhv) 		4 ALA C 216
ILE A 294
VAL C  55
PRO C  59
 None
 0.84A 6cduF-3j23C:
undetectable
6cduJ-3j23C:
undetectable		 6cduF-3j23C:
21.47
6cduJ-3j23C:
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.
3j4j TRANSLATION
INITIATION FACTOR
IF-2

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF04760
(IF2_N)
PF11987
(IF-2) 		4 ALA A 395
THR A 396
ILE A 388
VAL A 459
 None
 0.94A 6cduF-3j4jA:
undetectable
6cduJ-3j4jA:
undetectable		 6cduF-3j4jA:
21.22
6cduJ-3j4jA:
21.22
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.
3jd5 28S RIBOSOMAL
PROTEIN S11,
MITOCHONDRIAL

(Bos taurus) 		PF00411
(Ribosomal_S11) 		4 ALA K 142
THR K 143
ILE K 100
VAL K 102
 None
 0.85A 6cduF-3jd5K:
undetectable
6cduJ-3jd5K:
undetectable		 6cduF-3jd5K:
20.62
6cduJ-3jd5K:
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.
3jd5 28S RIBOSOMAL
PROTEIN S17,
MITOCHONDRIAL

(Bos taurus) 		PF00366
(Ribosomal_S17) 		4 ALA Q  26
THR Q  25
ILE Q  13
VAL Q  28
 None
C  A 120 ( 3.3A)
None
None
 0.83A 6cduF-3jd5Q:
undetectable
6cduJ-3jd5Q:
undetectable		 6cduF-3jd5Q:
17.65
6cduJ-3jd5Q:
17.65
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.
3kw8 PUTATIVE COPPER
OXIDASE

(Streptomyces
coelicolor) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ALA A 213
THR A 214
GLN A 272
VAL A 219
 None
 0.93A 6cduF-3kw8A:
undetectable
6cduJ-3kw8A:
undetectable		 6cduF-3kw8A:
21.05
6cduJ-3kw8A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lm7 PUTATIVE
4-HYDROXY-2-OXOGLUTA
RATE ALDOLASE /
2-DEHYDRO-3-DEOXYPHO
SPHOGLUCONATE
ALDOLASE

(Yersinia
enterocolitica) 		PF07071
(KDGP_aldolase) 		4 ALA A  58
ILE A  83
GLN A  86
VAL A  87
 None
 0.89A 6cduF-3lm7A:
undetectable
6cduJ-3lm7A:
undetectable		 6cduF-3lm7A:
21.52
6cduJ-3lm7A:
21.52
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.
3m0z PUTATIVE ALDOLASE

(Klebsiella
pneumoniae) 		PF07071
(KDGP_aldolase) 		4 ALA A  58
ILE A  83
GLN A  86
VAL A  87
 None
 0.84A 6cduF-3m0zA:
undetectable
6cduJ-3m0zA:
undetectable		 6cduF-3m0zA:
21.41
6cduJ-3m0zA:
21.41
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.
3mbf FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Encephalitozoon
cuniculi) 		PF00274
(Glycolytic) 		4 ALA A 166
ILE A 220
VAL A 218
PRO A 253
 None
 0.96A 6cduF-3mbfA:
undetectable
6cduJ-3mbfA:
undetectable		 6cduF-3mbfA:
22.52
6cduJ-3mbfA:
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.
3ml0 PENICILLIN G
ACYLASE, ALPHA
SUBUNIT
PENICILLIN G
ACYLASE, BETA
SUBUNIT

(Alcaligenes
faecalis;
Alcaligenes
faecalis) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		5 ALA A 156
THR A 155
ILE B 205
GLN B 203
VAL B 207
 None
 1.15A 6cduF-3ml0A:
undetectable
6cduJ-3ml0A:
undetectable		 6cduF-3ml0A:
19.21
6cduJ-3ml0A:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ng0 GLUTAMINE SYNTHETASE

(Synechocystis
sp. PCC 6803) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		4 ALA A  77
THR A  76
GLN A   6
VAL A   8
 None
 0.72A 6cduF-3ng0A:
undetectable
6cduJ-3ng0A:
undetectable		 6cduF-3ng0A:
21.15
6cduJ-3ng0A:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oqn CATABOLITE CONTROL
PROTEIN A

(Bacillus
subtilis) 		PF00356
(LacI)
PF13377
(Peripla_BP_3) 		4 ALA A  87
THR A  88
ILE A  95
VAL A  64
 None
 0.93A 6cduF-3oqnA:
undetectable
6cduJ-3oqnA:
undetectable		 6cduF-3oqnA:
21.80
6cduJ-3oqnA:
21.80
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.
3p1w RABGDI PROTEIN

(Plasmodium
falciparum) 		PF00996
(GDI) 		4 ALA A 368
THR A 369
ILE A 333
GLN A 331
 None
 0.81A 6cduF-3p1wA:
undetectable
6cduJ-3p1wA:
undetectable		 6cduF-3p1wA:
21.44
6cduJ-3p1wA:
21.44
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.
3puk SYNTAXIN-BINDING
PROTEIN 3

(Mus musculus) 		PF00995
(Sec1) 		4 ALA A 548
ILE A 567
GLN A 143
VAL A 147
 None
 0.82A 6cduF-3pukA:
undetectable
6cduJ-3pukA:
undetectable		 6cduF-3pukA:
19.77
6cduJ-3pukA:
19.77
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.
3sql GLYCOSYL HYDROLASE
FAMILY 3

(Synechococcus
sp. PCC 7002) 		PF00933
(Glyco_hydro_3) 		4 ALA A 321
THR A 320
VAL A 295
PRO A 308
 None
 0.86A 6cduF-3sqlA:
undetectable
6cduJ-3sqlA:
undetectable		 6cduF-3sqlA:
22.57
6cduJ-3sqlA:
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.
3syj ADHESION AND
PENETRATION PROTEIN
AUTOTRANSPORTER

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		4 ALA A 746
THR A 726
ILE A 732
VAL A 742
 None
 0.95A 6cduF-3syjA:
undetectable
6cduJ-3syjA:
undetectable		 6cduF-3syjA:
15.23
6cduJ-3syjA:
15.23
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.
3uxf FIMBRIAL SUBUNIT
TYPE 1

(Actinomyces
oris) 		no annotation 5 ALA A 321
THR A 320
ILE A 324
VAL A 228
PRO A 335
 None
 1.43A 6cduF-3uxfA:
2.7
6cduJ-3uxfA:
2.6		 6cduF-3uxfA:
20.55
6cduJ-3uxfA:
20.55
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.
3voh CELLOBIOHYDROLASE

(Coprinopsis
cinerea) 		PF01341
(Glyco_hydro_6) 		4 ALA A 140
THR A 141
ILE A 155
VAL A 153
 None
 0.88A 6cduF-3vohA:
undetectable
6cduJ-3vohA:
undetectable		 6cduF-3vohA:
22.22
6cduJ-3vohA:
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.
3vth HYDROGENASE
MATURATION FACTOR

(Caldanaerobacter
subterraneus) 		PF00708
(Acylphosphatase)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		4 ALA A 592
THR A 591
VAL A 594
PRO A 649
 None
 0.95A 6cduF-3vthA:
1.9
6cduJ-3vthA:
undetectable		 6cduF-3vthA:
17.30
6cduJ-3vthA:
17.30
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.
3w0l GLUCOKINASE
REGULATORY PROTEIN

(Xenopus laevis) 		no annotation 4 ALA B 265
THR B 266
ILE B  30
VAL B 249
 None
 0.96A 6cduF-3w0lB:
3.7
6cduJ-3w0lB:
2.4		 6cduF-3w0lB:
20.34
6cduJ-3w0lB:
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.
4atb INTERLEUKIN
ENHANCER-BINDING
FACTOR 2

(Mus musculus) 		PF07528
(DZF) 		4 ALA A 137
ILE A  99
GLN A  98
VAL A  97
 None
 0.88A 6cduF-4atbA:
undetectable
6cduJ-4atbA:
undetectable		 6cduF-4atbA:
19.13
6cduJ-4atbA:
19.13
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.
4cj0 ENDOGLUCANASE D
E12 AFFITIN

(Ruminiclostridium
thermocellum;
synthetic
construct) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N)
PF02294
(7kD_DNA_binding) 		4 ALA B  54
GLN B  35
VAL B  34
PRO A 539
 None
 0.88A 6cduF-4cj0B:
undetectable
6cduJ-4cj0B:
undetectable		 6cduF-4cj0B:
13.27
6cduJ-4cj0B:
13.27
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.
4cuk D-LACTATE
DEHYDROGENASE

(Salmonella
enterica) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 ALA A  42
THR A  41
ILE A  72
VAL A  69
 None
 0.94A 6cduF-4cukA:
undetectable
6cduJ-4cukA:
undetectable		 6cduF-4cukA:
21.35
6cduJ-4cukA:
21.35
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.
4e09 PLASMID PARTITIONING
PROTEIN PARF

(Escherichia
coli) 		PF01656
(CbiA) 		4 ALA A  25
THR A  24
ILE A 166
PRO A 104
 None
None
ACP  A 301 (-4.2A)
None
 0.70A 6cduF-4e09A:
undetectable
6cduJ-4e09A:
undetectable		 6cduF-4e09A:
21.05
6cduJ-4e09A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fmv GLUCURONOARABINOXYLA
N
ENDO-1,4-BETA-XYLANA
SE

([Clostridium]
papyrosolvens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		5 ALA A 332
THR A 331
GLN A 336
VAL A 334
PRO A 307
 None
 1.39A 6cduF-4fmvA:
undetectable
6cduJ-4fmvA:
undetectable		 6cduF-4fmvA:
20.35
6cduJ-4fmvA:
20.35
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.
4gyb COPPER OXIDASE

(Streptomyces
lividans) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ALA A 213
THR A 214
GLN A 272
VAL A 219
 None
 0.91A 6cduF-4gybA:
undetectable
6cduJ-4gybA:
undetectable		 6cduF-4gybA:
19.11
6cduJ-4gybA:
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.
4i6m ACTIN-LIKE PROTEIN
ARP9

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		4 ALA B 149
THR B 150
ILE B 162
VAL B 336
 None
 0.94A 6cduF-4i6mB:
undetectable
6cduJ-4i6mB:
undetectable		 6cduF-4i6mB:
22.62
6cduJ-4i6mB:
22.62
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.
4ife GENE 2 PROTEIN

(Shigella virus
Sf6) 		PF04466
(Terminase_3)
PF17288
(Terminase_3C) 		4 ALA A 281
THR A 282
ILE A 274
TRP A 295
 None
 0.89A 6cduF-4ifeA:
undetectable
6cduJ-4ifeA:
undetectable		 6cduF-4ifeA:
20.80
6cduJ-4ifeA:
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.
4igm 2-AMINO-3-CARBOXYMUC
ONATE-6-SEMIALDEHYDE
DECARBOXYLASE

(Homo sapiens) 		PF04909
(Amidohydro_2) 		4 ALA A 202
GLN A 142
VAL A 173
PRO A  77
 None
 0.94A 6cduF-4igmA:
undetectable
6cduJ-4igmA:
undetectable		 6cduF-4igmA:
20.11
6cduJ-4igmA:
20.11
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.
4iu2 CELL-WALL ANCHORING
PROTEIN

(Ruminococcus
flavefaciens) 		PF00963
(Cohesin) 		4 ALA A 196
ILE A 205
VAL A 143
PRO A 135
 SO4  A 308 ( 3.8A)
None
SO4  A 308 (-4.2A)
None
 0.92A 6cduF-4iu2A:
undetectable
6cduJ-4iu2A:
2.4		 6cduF-4iu2A:
21.05
6cduJ-4iu2A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4izo PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Burkholderia
thailandensis) 		PF02222
(ATP-grasp) 		4 ALA A 353
THR A 352
GLN A 346
VAL A 347
 None
 0.79A 6cduF-4izoA:
undetectable
6cduJ-4izoA:
undetectable		 6cduF-4izoA:
21.35
6cduJ-4izoA:
21.35
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.
4je4 MONOBODY NSA1

(Homo sapiens) 		PF00041
(fn3) 		4 ALA B  13
THR B  14
ILE B  71
VAL B  10
 None
 0.93A 6cduF-4je4B:
1.8
6cduJ-4je4B:
undetectable		 6cduF-4je4B:
16.06
6cduJ-4je4B:
16.06
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.
4kd5 ABC-TYPE TRANSPORT
SYSTEM,
MOLYBDENUM-SPECIFIC
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN

(Clostridioides
difficile) 		no annotation 4 ALA C 151
ILE C 215
GLN C 195
VAL C 194
 None
 0.82A 6cduF-4kd5C:
undetectable
6cduJ-4kd5C:
undetectable		 6cduF-4kd5C:
21.61
6cduJ-4kd5C:
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.
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica) 		PF02277
(DBI_PRT) 		4 ALA A 183
THR A 180
ILE A 298
VAL A 187
 None
SO4  A 402 (-2.9A)
None
None
 0.95A 6cduF-4kqkA:
undetectable
6cduJ-4kqkA:
undetectable		 6cduF-4kqkA:
22.04
6cduJ-4kqkA:
22.04
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.
4lix ENT-COPALYL
DIPHOSPHATE
SYNTHASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		4 ALA A 571
THR A 572
ILE A 480
VAL A 489
 None
 0.87A 6cduF-4lixA:
5.0
6cduJ-4lixA:
5.1		 6cduF-4lixA:
17.70
6cduJ-4lixA:
17.70
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.
4lnz UNCONVENTIONAL
MYOSIN-VB

(Homo sapiens) 		PF01843
(DIL) 		4 ALA A1609
ILE A1677
GLN A1680
VAL A1681
 None
 0.88A 6cduF-4lnzA:
undetectable
6cduJ-4lnzA:
2.7		 6cduF-4lnzA:
22.73
6cduJ-4lnzA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lxo FIBRONECTIN

(Homo sapiens) 		PF00041
(fn3) 		4 ALA A1428
THR A1429
ILE A1485
VAL A1425
 None
 0.95A 6cduF-4lxoA:
undetectable
6cduJ-4lxoA:
undetectable		 6cduF-4lxoA:
20.91
6cduJ-4lxoA:
20.91
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.
4m1r CELLULASE 5

(soil metagenome) 		PF00150
(Cellulase) 		4 ALA A 146
THR A 147
VAL A 164
PRO A 215
 None
 0.79A 6cduF-4m1rA:
undetectable
6cduJ-4m1rA:
undetectable		 6cduF-4m1rA:
21.84
6cduJ-4m1rA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nes UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Methanocaldococcus
jannaschii) 		PF02350
(Epimerase_2) 		4 ALA A 101
THR A  98
VAL A 105
PRO A  87
 None
 0.90A 6cduF-4nesA:
undetectable
6cduJ-4nesA:
undetectable		 6cduF-4nesA:
21.65
6cduJ-4nesA:
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.
4pxv CHITINASE A

(Pteris
ryukyuensis) 		PF01476
(LysM) 		4 THR A   3
ILE A   7
GLN A  43
VAL A  44
 None
 0.95A 6cduF-4pxvA:
undetectable
6cduJ-4pxvA:
undetectable		 6cduF-4pxvA:
10.07
6cduJ-4pxvA:
10.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q2c CRISPR-ASSOCIATED
HELICASE CAS3

(Thermobaculum
terrenum) 		PF00271
(Helicase_C) 		4 ALA A 337
THR A 334
ILE A 324
VAL A 505
 None
 0.95A 6cduF-4q2cA:
undetectable
6cduJ-4q2cA:
undetectable		 6cduF-4q2cA:
15.80
6cduJ-4q2cA:
15.80
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.
4q5h PROTEIN KINASE OSPG

(Shigella sonnei) 		no annotation 4 ALA A  39
THR A  38
ILE A 156
PRO A 105
 ANP  A 202 (-4.3A)
ANP  A 202 (-4.3A)
ANP  A 202 (-4.1A)
ANP  A 202 (-4.6A)
 0.93A 6cduF-4q5hA:
undetectable
6cduJ-4q5hA:
undetectable		 6cduF-4q5hA:
18.04
6cduJ-4q5hA:
18.04