SIMILAR PATTERNS OF AMINO ACIDS FOR 3ILU_E_HFZE800_1

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.
1euf DUODENASE

(Bos taurus) 		PF00089
(Trypsin) 		5 ILE A 231
PRO A 124
SER A 126
SER A 236
LEU A  53
 None
None
PO4  A 600 (-2.5A)
None
None
 1.36A 3iluB-1eufA:
0.0
3iluE-1eufA:
0.0		 3iluB-1eufA:
21.01
3iluE-1eufA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h5q NADP-DEPENDENT
MANNITOL
DEHYDROGENASE

(Agaricus
bisporus) 		PF13561
(adh_short_C2) 		5 ILE A 192
SER A  91
LYS A 141
GLY A 142
LEU A 136
 None
 1.33A 3iluB-1h5qA:
0.5
3iluE-1h5qA:
0.3		 3iluB-1h5qA:
20.29
3iluE-1h5qA:
20.29
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.
1hww ALPHA-MANNOSIDASE II

(Drosophila
melanogaster) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		5 GLY A 164
PRO A 197
SER A 200
LEU A1017
SER A 219
 None
 1.18A 3iluB-1hwwA:
0.0
3iluE-1hwwA:
0.0		 3iluB-1hwwA:
13.99
3iluE-1hwwA:
13.99
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.
1ldn L-LACTATE
DEHYDROGENASE

(Geobacillus
stearothermophilus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A 190
SER A 273
GLY A 288
LEU A 198
SER A 317
 None
 1.11A 3iluB-1ldnA:
0.0
3iluE-1ldnA:
0.0		 3iluB-1ldnA:
20.92
3iluE-1ldnA:
20.92
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.
1lvl DIHYDROLIPOAMIDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ILE A 188
SER A 198
GLY A 187
LYS A 192
LEU A 225
 None
 1.24A 3iluB-1lvlA:
0.0
3iluE-1lvlA:
0.0		 3iluB-1lvlA:
20.71
3iluE-1lvlA:
20.71
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.
1okc ADP, ATP CARRIER
PROTEIN HEART
ISOFORM T1

(Bos taurus) 		PF00153
(Mito_carr) 		5 ILE A 183
SER A 118
GLY A 119
LEU A 127
SER A 126
 CXT  A 401 (-4.8A)
None
None
CXT  A 401 (-4.1A)
CXT  A 401 ( 4.9A)
 1.35A 3iluB-1okcA:
undetectable
3iluE-1okcA:
undetectable		 3iluB-1okcA:
23.49
3iluE-1okcA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pww LETHAL FACTOR

(Bacillus
anthracis) 		PF07737
(ATLF)
PF09156
(Anthrax-tox_M) 		5 ILE A 151
SER A 156
LYS A 153
GLY A 152
LEU A 129
 None
 1.37A 3iluB-1pwwA:
0.0
3iluE-1pwwA:
0.0		 3iluB-1pwwA:
17.43
3iluE-1pwwA:
17.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qdl PROTEIN
(ANTHRANILATE
SYNTHASE
(TRPG-SUBUNIT))

(Sulfolobus
solfataricus) 		PF00117
(GATase) 		5 ILE B 187
PRO B 176
LYS B 186
GLY B 184
LEU B 122
 None
 1.35A 3iluB-1qdlB:
0.5
3iluE-1qdlB:
0.5		 3iluB-1qdlB:
21.69
3iluE-1qdlB:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qr4 PROTEIN (TENASCIN)

(Gallus gallus) 		PF00041
(fn3) 		5 ILE A  66
SER A  85
LYS A  83
GLY A  84
LEU A   6
 None
 1.16A 3iluB-1qr4A:
0.0
3iluE-1qr4A:
0.0		 3iluB-1qr4A:
22.69
3iluE-1qr4A:
22.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tcs TRICHOSANTHIN

(Trichosanthes
kirilowii) 		PF00161
(RIP) 		5 ILE A 171
SER A  11
LYS A 173
GLY A 172
LEU A 127
 None
 1.27A 3iluB-1tcsA:
0.0
3iluE-1tcsA:
0.0		 3iluB-1tcsA:
22.73
3iluE-1tcsA:
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.
1ty4 APOPTOSIS REGULATOR
CED-9
EGG LAYING DEFECTIVE
EGL-1, PROGRAMMED
CELL DEATH ACTIVATOR

(Caenorhabditis
elegans) 		PF00452
(Bcl-2)
PF02180
(BH4)
PF11430
(EGL-1) 		5 ILE C  54
SER C  48
GLY C  51
SER A 147
LEU C  58
 None
 1.31A 3iluB-1ty4C:
undetectable
3iluE-1ty4C:
undetectable		 3iluB-1ty4C:
13.78
3iluE-1ty4C:
13.78
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.
1un9 DIHYDROXYACETONE
KINASE

(Citrobacter
freundii) 		PF02733
(Dak1)
PF02734
(Dak2) 		5 SER A 304
GLY A 216
LYS A 243
SER A 188
LEU A 239
 None
 1.33A 3iluB-1un9A:
undetectable
3iluE-1un9A:
undetectable		 3iluB-1un9A:
17.87
3iluE-1un9A:
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.
1yrg GTPASE-ACTIVATING
PROTEIN RNA1_SCHPO

(Schizosaccharomyces
pombe) 		no annotation 5 ILE A 204
PRO A 201
GLY A 232
SER A 257
LEU A 223
 None
 1.35A 3iluB-1yrgA:
undetectable
3iluE-1yrgA:
undetectable		 3iluB-1yrgA:
21.26
3iluE-1yrgA:
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.
2e0w GAMMA-GLUTAMYLTRANSP
EPTIDASE

(Escherichia
coli) 		PF01019
(G_glu_transpept) 		5 ILE A 300
SER A 295
SER A 485
GLY A 296
LEU A 492
 None
 1.27A 3iluB-2e0wA:
undetectable
3iluE-2e0wA:
undetectable		 3iluB-2e0wA:
19.38
3iluE-2e0wA:
19.38
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.
2e0x GAMMA-GLUTAMYLTRANSP
EPTIDASE

(Escherichia
coli) 		PF01019
(G_glu_transpept) 		5 ILE A 300
SER A 295
SER B 485
GLY A 296
LEU B 492
 None
 1.28A 3iluB-2e0xA:
undetectable
3iluE-2e0xA:
undetectable		 3iluB-2e0xA:
21.20
3iluE-2e0xA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e5v L-ASPARTATE OXIDASE

(Sulfurisphaera
tokodaii) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 ILE A 121
SER A  36
GLY A 118
SER A 353
LEU A 125
 None
FAD  A1002 (-3.7A)
None
FAD  A1002 (-2.6A)
None
 1.37A 3iluB-2e5vA:
undetectable
3iluE-2e5vA:
undetectable		 3iluB-2e5vA:
20.67
3iluE-2e5vA:
20.67
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.
2gez L-ASPARAGINASE ALPHA
SUBUNIT

(Lupinus luteus) 		PF01112
(Asparaginase_2) 		5 SER A  97
GLY A  98
PRO A 105
LEU A 143
SER A  71
 None
 1.25A 3iluB-2gezA:
undetectable
3iluE-2gezA:
undetectable		 3iluB-2gezA:
20.23
3iluE-2gezA:
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.
2gpr GLUCOSE-PERMEASE IIA
COMPONENT

(Mycoplasma
capricolum) 		PF00358
(PTS_EIIA_1) 		5 ILE A  84
SER A 126
GLY A  85
PRO A  47
LEU A  82
 None
 1.03A 3iluB-2gprA:
undetectable
3iluE-2gprA:
undetectable		 3iluB-2gprA:
20.92
3iluE-2gprA:
20.92
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.
2grk EVM001

(Ectromelia
virus) 		PF02250
(Orthopox_35kD) 		5 ILE A  24
PRO A  87
SER A 109
GLY A  23
SER A 116
 None
 1.39A 3iluB-2grkA:
undetectable
3iluE-2grkA:
undetectable		 3iluB-2grkA:
22.01
3iluE-2grkA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jbh PHOSPHORIBOSYLTRANSF
ERASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00156
(Pribosyltran) 		5 ILE A  64
SER A 101
GLY A  65
SER A  93
LEU A 138
 None
 1.38A 3iluB-2jbhA:
undetectable
3iluE-2jbhA:
undetectable		 3iluB-2jbhA:
22.81
3iluE-2jbhA:
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.
2mwm PUTATIVE TRP
REPRESSOR BINDING
PROTEIN

(Lactobacillus
acidophilus) 		PF12682
(Flavodoxin_4) 		5 ILE A  82
SER A  12
GLY A  83
PRO A  94
LEU A  98
 None
 1.35A 3iluB-2mwmA:
undetectable
3iluE-2mwmA:
undetectable		 3iluB-2mwmA:
22.39
3iluE-2mwmA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2py0 FIMBRIAL PROTEIN

(Pseudomonas
aeruginosa) 		PF00114
(Pilin) 		5 ILE A 116
PRO A 139
SER A  31
GLY A  33
SER A  39
 None
 1.31A 3iluB-2py0A:
undetectable
3iluE-2py0A:
undetectable		 3iluB-2py0A:
19.75
3iluE-2py0A:
19.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qua EXTRACELLULAR LIPASE

(Serratia
marcescens) 		no annotation 5 ILE A 136
SER A  90
LYS A 126
GLY A 125
LEU A 196
 None
 1.13A 3iluB-2quaA:
undetectable
3iluE-2quaA:
undetectable		 3iluB-2quaA:
17.91
3iluE-2quaA:
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.
2vca ALPHA-N-ACETYLGLUCOS
AMINIDASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C)
PF05089
(NAGLU)
PF12971
(NAGLU_N)
PF12972
(NAGLU_C) 		5 ILE A 219
LYS A 242
GLY A 243
SER A 251
LEU A 196
 None
 1.36A 3iluB-2vcaA:
undetectable
3iluE-2vcaA:
undetectable		 3iluB-2vcaA:
14.40
3iluE-2vcaA:
14.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vg8 HYDROQUINONE
GLUCOSYLTRANSFERASE

(Arabidopsis
thaliana) 		PF00201
(UDPGT) 		5 ILE A 378
SER A 269
SER A 357
GLY A 359
LEU A 353
 None
 1.21A 3iluB-2vg8A:
undetectable
3iluE-2vg8A:
undetectable		 3iluB-2vg8A:
19.58
3iluE-2vg8A:
19.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zns GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 1

(Homo sapiens) 		PF10613
(Lig_chan-Glu_bd) 		5 ILE A 504
PRO A 517
SER A 746
LYS A 747
GLY A 748
 None
 0.64A 3iluB-2znsA:
37.5
3iluE-2znsA:
37.9		 3iluB-2znsA:
51.92
3iluE-2znsA:
51.92
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.
3dfy MUCONATE
CYCLOISOMERASE

(Thermotoga
maritima) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A  37
LYS A  44
GLY A  45
SER A 111
SER A  41
 None
 1.18A 3iluB-3dfyA:
undetectable
3iluE-3dfyA:
undetectable		 3iluB-3dfyA:
25.58
3iluE-3dfyA:
25.58
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.
3e7d COBH, PRECORRIN-8X
METHYLMUTASE

(Brucella
abortus) 		PF02570
(CbiC) 		5 ILE A 133
PRO A 161
GLY A 134
PRO A 137
SER A 115
 None
 1.14A 3iluB-3e7dA:
undetectable
3iluE-3e7dA:
undetectable		 3iluB-3e7dA:
21.71
3iluE-3e7dA:
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.
3fds DNA POLYMERASE
SLIDING CLAMP C

(Sulfolobus
solfataricus) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		5 ILE D  40
SER D  38
SER D 119
GLY D  39
PRO D 122
 None
 1.01A 3iluB-3fdsD:
undetectable
3iluE-3fdsD:
undetectable		 3iluB-3fdsD:
24.04
3iluE-3fdsD:
24.04
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.
3gqj CELL INHIBITING
FACTOR (CIF)

(Photorhabdus
laumondii) 		PF16374
(CIF) 		5 ILE A 276
SER A 235
GLY A 154
LEU A 278
SER A 160
 None
 1.22A 3iluB-3gqjA:
undetectable
3iluE-3gqjA:
undetectable		 3iluB-3gqjA:
21.00
3iluE-3gqjA:
21.00
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.
3h3j L-LACTATE
DEHYDROGENASE 1

(Staphylococcus
aureus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A 176
SER A 258
GLY A 273
LEU A 184
SER A 302
 None
 1.24A 3iluB-3h3jA:
undetectable
3iluE-3h3jA:
undetectable		 3iluB-3h3jA:
22.35
3iluE-3h3jA:
22.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3h6t GLUTAMATE RECEPTOR 2

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		6 ILE A  92
PRO A 105
SER A 108
SER A 217
LYS A 218
GLY A 219
 None
CYZ  A 265 (-3.9A)
CYZ  A 265 (-2.8A)
GOL  A 270 ( 3.0A)
None
None
 0.57A 3iluB-3h6tA:
43.8
3iluE-3h6tA:
43.3		 3iluB-3h6tA:
100.00
3iluE-3h6tA:
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.
3i8b XYLULOSE KINASE

(Bifidobacterium
adolescentis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ILE A 439
SER A 291
GLY A 433
SER A 295
LEU A 407
 None
 1.33A 3iluB-3i8bA:
undetectable
3iluE-3i8bA:
undetectable		 3iluB-3i8bA:
20.66
3iluE-3i8bA:
20.66
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.
3ihj ALANINE
AMINOTRANSFERASE 2

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		5 ILE A  75
GLY A 475
LYS A  85
PRO A  86
LEU A  79
 None
 1.32A 3iluB-3ihjA:
undetectable
3iluE-3ihjA:
undetectable		 3iluB-3ihjA:
18.90
3iluE-3ihjA:
18.90
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.
3ka7 OXIDOREDUCTASE

(Methanosarcina
mazei) 		PF01593
(Amino_oxidase) 		5 ILE A 198
PRO A 191
LYS A 196
GLY A 197
LEU A  10
 None
 1.15A 3iluB-3ka7A:
undetectable
3iluE-3ka7A:
undetectable		 3iluB-3ka7A:
20.56
3iluE-3ka7A:
20.56
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.
3lft UNCHARACTERIZED
PROTEIN

(Streptococcus
pneumoniae) 		PF04392
(ABC_sub_bind) 		5 ILE A 282
PRO A 166
SER A 317
LYS A 316
GLY A 315
 None
 1.34A 3iluB-3lftA:
undetectable
3iluE-3lftA:
3.6		 3iluB-3lftA:
24.92
3iluE-3lftA:
24.92
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.
3mog PROBABLE
3-HYDROXYBUTYRYL-COA
DEHYDROGENASE

(Escherichia
coli) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 ILE A  11
SER A  13
GLY A  12
SER A  37
LEU A  82
 None
 1.16A 3iluB-3mogA:
undetectable
3iluE-3mogA:
undetectable		 3iluB-3mogA:
20.04
3iluE-3mogA:
20.04
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.
3mos TRANSKETOLASE

(Homo sapiens) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ILE A 248
SER A  43
SER A  40
GLY A 245
LEU A 262
 None
TPP  A 700 ( 4.3A)
TPP  A 700 (-2.5A)
None
None
 1.21A 3iluB-3mosA:
undetectable
3iluE-3mosA:
undetectable		 3iluB-3mosA:
20.36
3iluE-3mosA:
20.36
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.
3nd0 SLL0855 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00654
(Voltage_CLC) 		5 ILE A 293
GLY A 291
SER A 134
LEU A 297
SER A 298
 None
 1.32A 3iluB-3nd0A:
undetectable
3iluE-3nd0A:
undetectable		 3iluB-3nd0A:
17.20
3iluE-3nd0A:
17.20
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.
3njx RHAMNOGALACTURONASE
B

(Aspergillus
aculeatus) 		PF09284
(RhgB_N)
PF14683
(CBM-like)
PF14686
(fn3_3) 		5 ILE A  51
SER A  57
GLY A  54
SER A  26
LEU A  78
 None
 1.40A 3iluB-3njxA:
undetectable
3iluE-3njxA:
undetectable		 3iluB-3njxA:
16.93
3iluE-3njxA:
16.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nnd POSSIBLE SUBSTRATE
BINDING PROTEIN OF
ABC TRANSPORTER
SYSTEM

(Rhodopseudomonas
palustris) 		no annotation 5 ILE B 147
PRO B 249
LYS B 149
GLY B 148
LYS B 212
 None
 0.83A 3iluB-3nndB:
undetectable
3iluE-3nndB:
undetectable		 3iluB-3nndB:
20.42
3iluE-3nndB:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3odg XANTHOSINE
PHOSPHORYLASE

(Yersinia
pseudotuberculosis) 		PF01048
(PNP_UDP_1) 		5 ILE A 104
PRO A  66
GLY A  94
PRO A 108
SER A 231
 None
 1.27A 3iluB-3odgA:
undetectable
3iluE-3odgA:
undetectable		 3iluB-3odgA:
23.12
3iluE-3odgA:
23.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3orq N5-CARBOXYAMINOIMIDA
ZOLE RIBONUCLEOTIDE
SYNTHETASE

(Staphylococcus
aureus) 		PF02222
(ATP-grasp)
PF02826
(2-Hacid_dh_C) 		5 ILE A 337
SER A 341
LYS A 340
GLY A 339
LEU A 320
 None
None
POP  A 377 (-2.9A)
None
None
 1.19A 3iluB-3orqA:
undetectable
3iluE-3orqA:
undetectable		 3iluB-3orqA:
21.17
3iluE-3orqA:
21.17
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.
3p0t UNCHARACTERIZED
PROTEIN

(Mycobacterium
avium) 		PF01230
(HIT) 		5 ILE A  67
SER A  80
LYS A  69
GLY A  68
LEU A 130
 None
 1.31A 3iluB-3p0tA:
undetectable
3iluE-3p0tA:
undetectable		 3iluB-3p0tA:
21.97
3iluE-3p0tA:
21.97
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.
3pqd L-LACTATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A 175
SER A 258
GLY A 273
LEU A 183
SER A 302
 None
 1.17A 3iluB-3pqdA:
undetectable
3iluE-3pqdA:
undetectable		 3iluB-3pqdA:
22.85
3iluE-3pqdA:
22.85
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.
3py9 PROTEIN KINASE

(Staphylococcus
aureus) 		PF03793
(PASTA) 		5 ILE A  13
SER A  16
LYS A  15
GLY A  14
LYS A  49
 None
 1.17A 3iluB-3py9A:
undetectable
3iluE-3py9A:
undetectable		 3iluB-3py9A:
25.08
3iluE-3py9A:
25.08
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.
3qqi HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 ILE A 267
SER A 265
SER A  85
GLY A 266
LEU A  61
 None
 1.30A 3iluB-3qqiA:
undetectable
3iluE-3qqiA:
undetectable		 3iluB-3qqiA:
19.00
3iluE-3qqiA:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ru6 OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Campylobacter
jejuni) 		PF00215
(OMPdecase) 		5 ILE A 209
PRO A 208
GLY A 206
PRO A 178
LEU A   3
 None
IOD  A 282 ( 4.1A)
IOD  A 284 ( 4.5A)
IOD  A 287 ( 4.1A)
None
 1.24A 3iluB-3ru6A:
undetectable
3iluE-3ru6A:
undetectable		 3iluB-3ru6A:
21.63
3iluE-3ru6A:
21.63
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.
3tmc UNCHARACTERIZED
PROTEIN

(Bdellovibrio
bacteriovorus) 		PF13487
(HD_5) 		5 ILE A 214
PRO A 213
LYS A 211
LYS A 247
PRO A 246
 None
 1.29A 3iluB-3tmcA:
undetectable
3iluE-3tmcA:
undetectable		 3iluB-3tmcA:
20.58
3iluE-3tmcA:
20.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3u92 GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 3

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		5 ILE A  91
PRO A 104
SER A 212
LYS A 213
GLY A 214
 None
 0.65A 3iluB-3u92A:
37.2
3iluE-3u92A:
37.5		 3iluB-3u92A:
51.34
3iluE-3u92A:
51.34
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.
3uf6 LMO1369 PROTEIN

(Listeria
monocytogenes) 		PF01515
(PTA_PTB) 		5 ILE A 208
SER A 222
GLY A 224
SER A 199
LEU A 204
 None
 1.10A 3iluB-3uf6A:
undetectable
3iluE-3uf6A:
undetectable		 3iluB-3uf6A:
21.22
3iluE-3uf6A:
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.
3vot L-AMINO ACID LIGASE,
BL00235

(Bacillus
licheniformis) 		PF13535
(ATP-grasp_4) 		5 SER A 304
LYS A 302
GLY A 306
SER A 221
LEU A 312
 None
 1.08A 3iluB-3votA:
undetectable
3iluE-3votA:
undetectable		 3iluB-3votA:
20.41
3iluE-3votA:
20.41
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.
3vxi DYP

(Bjerkandera
adusta) 		PF04261
(Dyp_perox) 		5 ILE A  11
GLY A  13
SER A 330
LEU A 198
SER A 216
 None
 1.23A 3iluB-3vxiA:
undetectable
3iluE-3vxiA:
undetectable		 3iluB-3vxiA:
19.73
3iluE-3vxiA:
19.73
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.
4am6 ACTIN-LIKE PROTEIN
ARP8

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		5 ILE A 278
PRO A 273
GLY A 274
SER A 407
LEU A 428
 None
None
SO4  A1882 (-3.1A)
None
None
 1.27A 3iluB-4am6A:
undetectable
3iluE-4am6A:
undetectable		 3iluB-4am6A:
17.25
3iluE-4am6A:
17.25
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.
4asl EPA1P

([Candida]
glabrata) 		PF10528
(GLEYA) 		5 ILE A 219
SER A 254
SER A  62
GLY A 147
LEU A 221
 None
 1.07A 3iluB-4aslA:
undetectable
3iluE-4aslA:
undetectable		 3iluB-4aslA:
22.80
3iluE-4aslA:
22.80
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.
4c9g ADP, ATP CARRIER
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00153
(Mito_carr) 		5 ILE A 200
SER A 133
GLY A 134
LEU A 142
SER A 141
 ILE  A 200 ( 0.7A)
SER  A 133 ( 0.0A)
GLY  A 134 ( 0.0A)
LEU  A 142 ( 0.6A)
SER  A 141 ( 0.0A)
 1.36A 3iluB-4c9gA:
undetectable
3iluE-4c9gA:
undetectable		 3iluB-4c9gA:
22.02
3iluE-4c9gA:
22.02
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.
4cgn GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Leishmania
major) 		PF01233
(NMT)
PF02799
(NMT_C) 		5 ILE A 235
PRO A 236
SER A 233
GLY A 234
SER A 221
 None
 1.39A 3iluB-4cgnA:
undetectable
3iluE-4cgnA:
undetectable		 3iluB-4cgnA:
20.40
3iluE-4cgnA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gx8 DNA POLYMERASE III
SUBUNIT EPSILON,DNA
POLYMERASE III
SUBUNIT ALPHA

(Escherichia
coli) 		PF02811
(PHP) 		5 ILE A 107
PRO A 109
GLY A 102
LEU A  33
SER A  31
 None
 1.36A 3iluB-4gx8A:
undetectable
3iluE-4gx8A:
undetectable		 3iluB-4gx8A:
21.98
3iluE-4gx8A:
21.98
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.
4itc LYS-GINGIPAIN W83

(Porphyromonas
gingivalis) 		PF07675
(Cleaved_Adhesin) 		5 ILE A 993
PRO A 994
SER A 988
GLY A 992
LEU A1045
 GAI  A1206 (-4.0A)
GOL  A1207 ( 4.9A)
None
None
None
 1.40A 3iluB-4itcA:
undetectable
3iluE-4itcA:
undetectable		 3iluB-4itcA:
21.17
3iluE-4itcA:
21.17
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.
4j1y COMPLEMENT C1S
SUBCOMPONENT

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		5 ILE A 361
PRO A 362
GLY A 360
PRO A 373
SER A 380
 None
 1.39A 3iluB-4j1yA:
undetectable
3iluE-4j1yA:
undetectable		 3iluB-4j1yA:
22.42
3iluE-4j1yA:
22.42
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.
4k3c OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMA

([Haemophilus]
ducreyi) 		PF01103
(Bac_surface_Ag)
PF07244
(POTRA) 		5 ILE A 782
PRO A 773
GLY A 661
LYS A 776
SER A 666
 None
 1.05A 3iluB-4k3cA:
undetectable
3iluE-4k3cA:
undetectable		 3iluB-4k3cA:
20.24
3iluE-4k3cA:
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.
4ln1 L-LACTATE
DEHYDROGENASE 1

(Bacillus cereus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A 175
SER A 258
GLY A 273
LEU A 183
SER A 302
 None
 1.23A 3iluB-4ln1A:
undetectable
3iluE-4ln1A:
undetectable		 3iluB-4ln1A:
23.84
3iluE-4ln1A:
23.84
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.
4mhc NUCLEOPORIN NUP157

(Saccharomyces
cerevisiae) 		PF08801
(Nucleoporin_N) 		5 ILE A 506
PRO A 543
GLY A 505
LEU A 599
SER A 576
 None
 1.20A 3iluB-4mhcA:
undetectable
3iluE-4mhcA:
undetectable		 3iluB-4mhcA:
15.74
3iluE-4mhcA:
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.
4r7a HISTONE-BINDING
PROTEIN RBBP4

(Homo sapiens) 		PF00400
(WD40)
PF12265
(CAF1C_H4-bd) 		5 ILE B 254
SER B 234
GLY B 244
SER B 280
LEU B 306
 None
 1.27A 3iluB-4r7aB:
undetectable
3iluE-4r7aB:
undetectable		 3iluB-4r7aB:
19.67
3iluE-4r7aB:
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.
4sli INTRAMOLECULAR
TRANS-SIALIDASE

(Macrobdella
decora) 		PF02973
(Sialidase)
PF13088
(BNR_2) 		5 ILE A 398
SER A 370
SER A 321
LYS A 320
GLY A 397
 None
 1.19A 3iluB-4sliA:
undetectable
3iluE-4sliA:
undetectable		 3iluB-4sliA:
17.60
3iluE-4sliA:
17.60
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.
4ut1 FLAGELLAR
HOOK-ASSOCIATED
PROTEIN

(Burkholderia
pseudomallei) 		PF06429
(Flg_bbr_C) 		5 ILE A 399
GLY A 386
SER A 383
LEU A 367
SER A 368
 None
 1.34A 3iluB-4ut1A:
undetectable
3iluE-4ut1A:
undetectable		 3iluB-4ut1A:
16.17
3iluE-4ut1A:
16.17
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.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		5 ILE A 350
SER A 322
SER A 273
LYS A 272
GLY A 349
 None
 1.21A 3iluB-4xhbA:
undetectable
3iluE-4xhbA:
undetectable		 3iluB-4xhbA:
17.42
3iluE-4xhbA:
17.42
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.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE

(Vesicular
stomatitis
virus) 		PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap) 		5 ILE A 884
PRO A 933
SER A 952
GLY A 885
SER A1093
 None
 1.32A 3iluB-5a22A:
undetectable
3iluE-5a22A:
undetectable		 3iluB-5a22A:
8.17
3iluE-5a22A:
8.17
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.
5bob TRANSLATION
INITIATION FACTOR 2
(IF-2 GTPASE)

(Streptococcus
suis) 		no annotation 5 ILE A 287
SER A 317
SER A 189
GLY A 195
LEU A 293
 None
 1.30A 3iluB-5bobA:
undetectable
3iluE-5bobA:
undetectable		 3iluB-5bobA:
21.30
3iluE-5bobA:
21.30
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.
5bs5 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Acinetobacter
baumannii) 		PF00275
(EPSP_synthase) 		5 ILE A 488
SER A 414
GLY A 487
LEU A 477
SER A 481
 None
 1.37A 3iluB-5bs5A:
undetectable
3iluE-5bs5A:
undetectable		 3iluB-5bs5A:
22.19
3iluE-5bs5A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cef ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Cryptococcus
neoformans) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 ILE A  23
SER A  87
GLY A  19
SER A 351
LEU A  34
 None
 1.39A 3iluB-5cefA:
undetectable
3iluE-5cefA:
undetectable		 3iluB-5cefA:
21.32
3iluE-5cefA:
21.32
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.
5dzt CYLM

(Enterococcus
faecalis) 		PF05147
(LANC_like)
PF13575
(DUF4135) 		5 ILE A 769
SER A 738
GLY A 744
SER A 794
LEU A 750
 None
 1.38A 3iluB-5dztA:
undetectable
3iluE-5dztA:
undetectable		 3iluB-5dztA:
12.72
3iluE-5dztA:
12.72
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.
5fby SEPARASE

(Chaetomium
thermophilum) 		PF03568
(Peptidase_C50) 		5 ILE A2077
PRO A2076
SER A2054
GLY A2024
PRO A2020
 None
 1.10A 3iluB-5fbyA:
undetectable
3iluE-5fbyA:
undetectable		 3iluB-5fbyA:
17.94
3iluE-5fbyA:
17.94
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.
5g37 41.9 KDA
INSECTICIDAL TOXIN

(Lysinibacillus
sphaericus) 		PF05431
(Toxin_10) 		5 ILE A 175
SER A 173
GLY A 174
LEU A 229
SER A 227
 None
 1.20A 3iluB-5g37A:
undetectable
3iluE-5g37A:
undetectable		 3iluB-5g37A:
20.90
3iluE-5g37A:
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.
5hn4 HOMOISOCITRATE
DEHYDROGENASE

(Thermococcus
kodakarensis) 		PF00180
(Iso_dh) 		5 ILE A  17
SER A 252
GLY A  13
PRO A 248
LEU A  65
 None
 1.16A 3iluB-5hn4A:
undetectable
3iluE-5hn4A:
undetectable		 3iluB-5hn4A:
22.16
3iluE-5hn4A:
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.
5i4c TRANSCRIPTIONAL
REGULATORY PROTEIN
RCSB

(Escherichia
coli) 		PF00072
(Response_reg) 		5 ILE A  68
GLY A  67
LYS A  72
SER A  38
LEU A 101
 None
 1.30A 3iluB-5i4cA:
undetectable
3iluE-5i4cA:
undetectable		 3iluB-5i4cA:
21.63
3iluE-5i4cA:
21.63
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.
5irp ALANINE RACEMASE 2

(Bacillus
subtilis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 ILE A 289
SER A 296
GLY A 290
SER A 300
LEU A 253
 None
 1.32A 3iluB-5irpA:
undetectable
3iluE-5irpA:
undetectable		 3iluB-5irpA:
21.64
3iluE-5irpA:
21.64
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.
5kc8 GLUTAMATE RECEPTOR
IONOTROPIC, DELTA-2

(Homo sapiens) 		PF01094
(ANF_receptor) 		5 ILE A  90
SER A 352
GLY A  89
SER A 354
LEU A  93
 None
 1.33A 3iluB-5kc8A:
undetectable
3iluE-5kc8A:
undetectable		 3iluB-5kc8A:
19.63
3iluE-5kc8A:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l2e GLUTAMATE RECEPTOR
IONOTROPIC,
DELTA-2,GLUTAMATE
RECEPTOR IONOTROPIC,
DELTA-2

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 ILE A  90
SER A 352
GLY A  89
SER A 354
LEU A  93
 None
 1.31A 3iluB-5l2eA:
27.8
3iluE-5l2eA:
27.8		 3iluB-5l2eA:
16.59
3iluE-5l2eA:
16.59
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.
5my0 FATTY ACID SYNTHASE

(Mus musculus) 		no annotation 5 ILE B 188
SER B 164
SER B 336
GLY B 187
LEU B 190
 None
 1.31A 3iluB-5my0B:
undetectable
3iluE-5my0B:
undetectable		 3iluB-5my0B:
13.95
3iluE-5my0B:
13.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n0g PRECORRIN-8X
METHYLMUTASE

(Rhodobacter
capsulatus) 		no annotation 5 ILE A 134
PRO A 163
GLY A 135
PRO A 138
SER A 116
 None
 1.13A 3iluB-5n0gA:
undetectable
3iluE-5n0gA:
undetectable		 3iluB-5n0gA:
15.42
3iluE-5n0gA:
15.42
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.
5n8n EVPB FAMILY TYPE VI
SECRETION PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 ILE B 194
SER B 369
SER B 237
GLY B 241
PRO B 192
 None
 1.23A 3iluB-5n8nB:
undetectable
3iluE-5n8nB:
undetectable		 3iluB-5n8nB:
14.40
3iluE-5n8nB:
14.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n8n EVPB FAMILY TYPE VI
SECRETION PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 ILE B 194
SER B 369
SER B 237
GLY B 241
SER B 186
 None
 1.21A 3iluB-5n8nB:
undetectable
3iluE-5n8nB:
undetectable		 3iluB-5n8nB:
14.40
3iluE-5n8nB:
14.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nop ATTACHMENT
GLYCOPROTEIN

(Mojiang
henipavirus) 		PF00423
(HN) 		5 ILE A 514
PRO A 516
SER A 518
LEU A 465
SER A 483
 None
 1.38A 3iluB-5nopA:
undetectable
3iluE-5nopA:
undetectable		 3iluB-5nopA:
19.62
3iluE-5nopA:
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.
5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)

(Neisseria
gonorrhoeae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ILE A 301
SER A 286
GLY A 308
SER A 164
LEU A 299
 None
FAD  A 601 ( 3.8A)
None
FAD  A 601 ( 3.9A)
None
 1.32A 3iluB-5u25A:
undetectable
3iluE-5u25A:
undetectable		 3iluB-5u25A:
18.96
3iluE-5u25A:
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.
5uj1 DNA TOPOISOMERASE 1

(Mycobacterium
tuberculosis) 		no annotation 5 ILE A 141
GLY A 338
LYS A  28
LEU A  32
SER A  34
 None
 0.94A 3iluB-5uj1A:
undetectable
3iluE-5uj1A:
undetectable		 3iluB-5uj1A:
14.92
3iluE-5uj1A:
14.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wel CHIMERA OF GLUTAMATE
RECEPTOR 2, GERM
CELL-SPECIFIC GENE
1-LIKE PROTEIN

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF07803
(GSG-1)
PF10613
(Lig_chan-Glu_bd) 		5 ILE A 481
PRO A 494
SER A 497
SER A 729
GLY A 731
 None
 0.70A 3iluB-5welA:
32.7
3iluE-5welA:
32.4		 3iluB-5welA:
66.93
3iluE-5welA:
66.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wel CHIMERA OF GLUTAMATE
RECEPTOR 2, GERM
CELL-SPECIFIC GENE
1-LIKE PROTEIN

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF07803
(GSG-1)
PF10613
(Lig_chan-Glu_bd) 		5 ILE A 481
PRO A 494
SER A 729
LYS A 730
GLY A 731
 None
 0.82A 3iluB-5welA:
32.7
3iluE-5welA:
32.4		 3iluB-5welA:
66.93
3iluE-5welA:
66.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5weo GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT
CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF00822
(PMP22_Claudin)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		6 ILE A 481
PRO A 494
SER A 497
SER A 729
LYS A 730
GLY A 731
 None
CYZ  A1302 (-4.5A)
CYZ  A1302 (-3.2A)
None
GLU  A1301 ( 3.7A)
None
 0.68A 3iluB-5weoA:
25.3
3iluE-5weoA:
25.2		 3iluB-5weoA:
66.93
3iluE-5weoA:
66.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5weo GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT
CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF00822
(PMP22_Claudin)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 LYS A 493
PRO A 494
SER A 497
LEU A 751
SER A 754
 None
CYZ  A1302 (-4.5A)
CYZ  A1302 (-3.2A)
None
CYZ  A1302 ( 4.1A)
 0.93A 3iluB-5weoA:
25.3
3iluE-5weoA:
25.2		 3iluB-5weoA:
66.93
3iluE-5weoA:
66.93
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.
5wlh LBACAS13A H328A
(C2C2)

(Lachnospiraceae
bacterium
NK4A179) 		no annotation 5 SER A 568
SER A 979
GLY A 566
SER A 976
LEU A1043
 None
 1.37A 3iluB-5wlhA:
undetectable
3iluE-5wlhA:
undetectable		 3iluB-5wlhA:
11.69
3iluE-5wlhA:
11.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wue UNCHARACTERIZED
PROTEIN

(Sulfolobus
acidocaldarius) 		PF03458
(UPF0126) 		5 ILE A 138
GLY A 136
SER A  23
LEU A 142
SER A 143
 None
 1.00A 3iluB-5wueA:
undetectable
3iluE-5wueA:
undetectable		 3iluB-5wueA:
21.62
3iluE-5wueA:
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.
5x5g BETA-LACTAMASE

(Serratia
marcescens) 		PF13354
(Beta-lactamase2) 		5 ILE A 242
SER A  56
SER A 227
SER A 120
LEU A 211
 None
OP0  A 305 (-1.5A)
OP0  A 305 (-2.4A)
OP0  A 305 (-2.7A)
None
 1.40A 3iluB-5x5gA:
undetectable
3iluE-5x5gA:
undetectable		 3iluB-5x5gA:
22.74
3iluE-5x5gA:
22.74
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.
5yzc GLYCOPROTEIN
F1,MEASLES VIRUS
FUSION PROTEIN

(Measles
morbillivirus) 		no annotation 5 ILE B 265
PRO B 286
SER B 344
GLY B 264
LEU B 246
 None
 1.32A 3iluB-5yzcB:
undetectable
3iluE-5yzcB:
undetectable		 3iluB-5yzcB:
14.40
3iluE-5yzcB:
14.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6arx ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 5 ILE A 276
SER A 360
GLY A 362
SER A 280
LEU A 307
 None
 1.37A 3iluB-6arxA:
undetectable
3iluE-6arxA:
undetectable		 3iluB-6arxA:
17.24
3iluE-6arxA:
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.
6bxe VARIABLE LYMPHOCYTE
RECEPTOR DIVERSITY
REGION

(Petromyzon
marinus) 		no annotation 5 ILE A  47
PRO A  23
SER A  42
GLY A  45
LEU A  54
 None
 1.34A 3iluB-6bxeA:
undetectable
3iluE-6bxeA:
undetectable		 3iluB-6bxeA:
14.40
3iluE-6bxeA:
14.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cmz DIHYDROLIPOYL
DEHYDROGENASE

(Burkholderia
cenocepacia) 		no annotation 5 ILE A 192
SER A 202
GLY A 191
LYS A 196
LEU A 229
 None
 1.19A 3iluB-6cmzA:
undetectable
3iluE-6cmzA:
undetectable		 3iluB-6cmzA:
18.55
3iluE-6cmzA:
18.55
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.
6d04 RETICULOCYTE BINDING
PROTEIN 2, PUTATIVE

(Plasmodium
vivax) 		no annotation 5 ILE E 567
PRO E 568
LYS E 576
LEU E 580
SER E 582
 None
 1.10A 3iluB-6d04E:
undetectable
3iluE-6d04E:
undetectable		 3iluB-6d04E:
22.35
3iluE-6d04E:
22.35
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.
6eo2 TRANSCRIPTIONAL
REGULATORY PROTEIN
RCSB

(Salmonella
enterica) 		no annotation 5 ILE A  68
GLY A  67
LYS A  72
SER A  38
LEU A 101
 None
 1.27A 3iluB-6eo2A:
undetectable
3iluE-6eo2A:
undetectable		 3iluB-6eo2A:
25.76
3iluE-6eo2A:
25.76
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.
6epe PROTEASOME SUBUNIT
BETA TYPE-1

(Rattus
norvegicus) 		no annotation 5 ILE 6 115
GLY 6 113
SER 6 105
LEU 6 119
SER 6 120
 None
 1.15A 3iluB-6epe6:
undetectable
3iluE-6epe6:
undetectable		 3iluB-6epe6:
17.02
3iluE-6epe6:
17.02