SIMILAR PATTERNS OF AMINO ACIDS FOR 4X3M_B_ADNB301_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.
1azz COLLAGENASE

(Leptuca
pugilator)
PF00089
(Trypsin)
5 PRO A 198
LEU A  33
ILE A 212
LEU A  53
THR A  54
None
1.22A 4x3mB-1azzA:
undetectable
4x3mB-1azzA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d1t ALCOHOL
DEHYDROGENASE CLASS
IV SIGMA CHAIN


(Homo sapiens)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
5 PRO A 243
LEU A 200
GLY A 199
ILE A 241
VAL A 197
None
None
NAD  A1377 ( 3.7A)
None
None
1.17A 4x3mB-1d1tA:
2.6
4x3mB-1d1tA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fiw BETA-ACROSIN HEAVY
CHAIN


(Ovis aries)
PF00089
(Trypsin)
5 PRO A 198
LEU A  33
ILE A 212
LEU A  53
THR A  54
None
1.22A 4x3mB-1fiwA:
undetectable
4x3mB-1fiwA:
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.
1fuj PR3

(Homo sapiens)
PF00089
(Trypsin)
5 PRO A 198
LEU A  33
ILE A 212
LEU A  53
THR A  54
None
1.26A 4x3mB-1fujA:
undetectable
4x3mB-1fujA:
21.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gz0 HYPOTHETICAL
TRNA/RRNA
METHYLTRANSFERASE
YJFH


(Escherichia
coli)
PF00588
(SpoU_methylase)
PF08032
(SpoU_sub_bind)
6 GLY A 196
ILE A 216
MET A 218
SER A 224
LEU A 225
VAL A 227
None
0.95A 4x3mB-1gz0A:
9.2
4x3mB-1gz0A:
30.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gz0 HYPOTHETICAL
TRNA/RRNA
METHYLTRANSFERASE
YJFH


(Escherichia
coli)
PF00588
(SpoU_methylase)
PF08032
(SpoU_sub_bind)
5 GLY A 201
ILE A 216
MET A 218
SER A 224
LEU A 225
None
0.96A 4x3mB-1gz0A:
9.2
4x3mB-1gz0A:
30.11
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.
1hyl HYPODERMA LINEATUM
COLLAGENASE


(Hypoderma
lineatum)
PF00089
(Trypsin)
5 PRO A 198
LEU A  33
GLY A  32
LEU A  53
THR A  54
None
1.17A 4x3mB-1hylA:
undetectable
4x3mB-1hylA:
20.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ipa RNA 2'-O-RIBOSE
METHYLTRANSFERASE


(Thermus
thermophilus)
PF00588
(SpoU_methylase)
PF08032
(SpoU_sub_bind)
6 GLY A 215
ILE A 235
MET A 237
SER A 243
LEU A 244
VAL A 246
None
0.74A 4x3mB-1ipaA:
30.4
4x3mB-1ipaA:
53.93
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.
1j0n XANTHAN LYASE

(Bacillus sp.
GL1)
PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N)
5 GLY A 194
ILE A 202
MET A 156
VAL A 259
THR A 262
None
1.10A 4x3mB-1j0nA:
undetectable
4x3mB-1j0nA:
17.26
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.
1jqo PHOSPHOENOLPYRUVATE
CARBOXYLASE


(Zea mays)
PF00311
(PEPcase)
6 LEU A  83
GLY A  84
ILE A 102
LEU A 901
VAL A 903
THR A 900
None
1.14A 4x3mB-1jqoA:
2.3
4x3mB-1jqoA:
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.
1kig FACTOR XA

(Bos taurus)
PF00089
(Trypsin)
5 PRO H 198
LEU H  33
ILE H 212
LEU H  53
THR H  54
None
1.15A 4x3mB-1kigH:
undetectable
4x3mB-1kigH:
20.07
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.
1r1a HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP1)
HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP2)


(Rhinovirus A)
PF00073
(Rhv)
5 LEU 2 173
GLY 2 177
ILE 1 278
VAL 1 257
THR 1 276
None
1.23A 4x3mB-1r1a2:
undetectable
4x3mB-1r1a2:
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.
1u3t ALCOHOL
DEHYDROGENASE ALPHA
CHAIN


(Homo sapiens)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
5 PRO A 243
LEU A 200
GLY A 199
ILE A 241
VAL A 197
None
None
NAD  A1377 (-3.5A)
None
None
1.26A 4x3mB-1u3tA:
2.3
4x3mB-1u3tA:
22.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1v2x TRNA (GM18)
METHYLTRANSFERASE


(Thermus
thermophilus)
PF00588
(SpoU_methylase)
PF12105
(SpoU_methylas_C)
6 GLY A 122
ILE A 142
MET A 144
SER A 150
LEU A 151
VAL A 153
SAM  A 400 (-3.2A)
SAM  A 400 (-3.6A)
SAM  A 400 (-3.3A)
SAM  A 400 ( 3.7A)
SAM  A 400 (-4.0A)
SAM  A 400 (-3.9A)
0.41A 4x3mB-1v2xA:
16.9
4x3mB-1v2xA:
30.30
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.
1vpl ABC TRANSPORTER,
ATP-BINDING PROTEIN


(Thermotoga
maritima)
PF00005
(ABC_tran)
5 PRO A  37
GLY A 210
ILE A  35
MET A 194
LEU A 206
None
1.21A 4x3mB-1vplA:
undetectable
4x3mB-1vplA:
20.28
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.
1wyz PUTATIVE
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE


(Bacteroides
thetaiotaomicron)
no annotation 5 LEU A 231
ILE A 201
SER A 122
LEU A 126
VAL A 128
None
0.83A 4x3mB-1wyzA:
2.4
4x3mB-1wyzA:
24.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1x7p RRNA
METHYLTRANSFERASE


(Streptomyces
viridochromogenes)
PF00588
(SpoU_methylase)
5 GLY A 232
ILE A 252
MET A 254
SER A 260
LEU A 261
SAM  A 301 (-3.2A)
SAM  A 301 (-4.0A)
SAM  A 301 (-3.1A)
SAM  A 301 ( 3.7A)
SAM  A 301 (-4.1A)
0.87A 4x3mB-1x7pA:
27.9
4x3mB-1x7pA:
34.12
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.
1zjr TRNA
(GUANOSINE-2'-O-)-ME
THYLTRANSFERASE


(Aquifex
aeolicus)
PF00588
(SpoU_methylase)
PF12105
(SpoU_methylas_C)
6 GLY A 126
ILE A 146
MET A 148
SER A 154
LEU A 155
VAL A 157
GOL  A 529 (-4.0A)
None
None
GOL  A 529 (-3.5A)
None
GOL  A 529 (-3.7A)
0.61A 4x3mB-1zjrA:
15.4
4x3mB-1zjrA:
24.16
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.
2ddt SPHINGOMYELIN
PHOSPHODIESTERASE


(Bacillus cereus)
PF03372
(Exo_endo_phos)
5 LEU A  78
GLY A  79
ILE A 115
LEU A  90
VAL A 118
None
0.86A 4x3mB-2ddtA:
undetectable
4x3mB-2ddtA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dm4 SORTILIN-RELATED
RECEPTOR


(Homo sapiens)
PF00041
(fn3)
5 PRO A  19
GLY A 102
ILE A  26
LEU A  70
VAL A  72
None
1.01A 4x3mB-2dm4A:
undetectable
4x3mB-2dm4A:
16.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ef4 ARGINASE

(Thermus
thermophilus)
PF00491
(Arginase)
5 PRO A  90
GLY A 102
ILE A  91
SER A 258
LEU A 259
None
1.22A 4x3mB-2ef4A:
undetectable
4x3mB-2ef4A:
28.25
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.
2ei8 COAGULATION FACTOR
X, HEAVY CHAIN


(Homo sapiens)
PF00089
(Trypsin)
5 PRO A 198
LEU A  33
ILE A 212
LEU A  53
THR A  54
None
1.14A 4x3mB-2ei8A:
undetectable
4x3mB-2ei8A:
20.22
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.
2ha8 TAR (HIV-1) RNA LOOP
BINDING PROTEIN


(Homo sapiens)
PF00588
(SpoU_methylase)
6 LEU A 128
GLY A 129
ILE A 149
SER A 157
LEU A 158
VAL A 160
SAH  A 401 ( 4.6A)
SAH  A 401 (-3.1A)
SAH  A 401 (-3.8A)
SAH  A 401 ( 3.8A)
SAH  A 401 (-4.3A)
SAH  A 401 (-3.6A)
0.81A 4x3mB-2ha8A:
17.1
4x3mB-2ha8A:
26.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2i6d RNA
METHYLTRANSFERASE,
TRMH FAMILY


(Porphyromonas
gingivalis)
PF00588
(SpoU_methylase)
5 LEU A 202
GLY A 203
ILE A 223
LEU A 237
VAL A 239
None
0.91A 4x3mB-2i6dA:
24.6
4x3mB-2i6dA:
32.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2i6d RNA
METHYLTRANSFERASE,
TRMH FAMILY


(Porphyromonas
gingivalis)
PF00588
(SpoU_methylase)
5 LEU A 202
ILE A 223
SER A 236
LEU A 237
VAL A 239
None
0.93A 4x3mB-2i6dA:
24.6
4x3mB-2i6dA:
32.71
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.
2jh9 VP4 CORE PROTEIN

(Bluetongue
virus)
PF05059
(Orbi_VP4)
5 GLY A 439
ILE A 424
MET A 428
LEU A 412
THR A 413
None
1.22A 4x3mB-2jh9A:
undetectable
4x3mB-2jh9A:
15.81
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.
2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE


(Escherichia
coli)
PF00275
(EPSP_synthase)
5 PRO A 181
GLY A 159
ILE A 215
MET A 208
LEU A 177
None
1.24A 4x3mB-2qfqA:
undetectable
4x3mB-2qfqA:
22.79
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.
2vsm HEMAGGLUTININ-NEURAM
INIDASE


(Nipah
henipavirus)
PF00423
(HN)
5 PRO A 273
LEU A 319
GLY A 251
VAL A 293
THR A 317
None
1.05A 4x3mB-2vsmA:
undetectable
4x3mB-2vsmA:
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.
2xa7 AP-2 COMPLEX SUBUNIT
BETA


(Homo sapiens)
PF01602
(Adaptin_N)
5 LEU B 257
GLY B 568
ILE B 306
LEU B 303
VAL B 301
None
1.06A 4x3mB-2xa7B:
undetectable
4x3mB-2xa7B:
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.
2xxl GRAM-POSITIVE
SPECIFIC SERINE
PROTEASE, ISOFORM B


(Drosophila
melanogaster)
PF00089
(Trypsin)
PF12032
(CLIP)
5 PRO A 321
LEU A 136
ILE A 341
LEU A 159
THR A 160
None
1.19A 4x3mB-2xxlA:
undetectable
4x3mB-2xxlA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a14 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE


(Thermotoga
maritima)
PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C)
5 LEU A 262
ILE A   8
LEU A  20
VAL A  22
THR A  19
None
1.17A 4x3mB-3a14A:
2.8
4x3mB-3a14A:
24.80
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.
3bry TBUX

(Ralstonia
pickettii)
PF03349
(Toluene_X)
5 PRO A  34
LEU A  39
GLY A  38
LEU A 225
THR A 226
None
1.21A 4x3mB-3bryA:
undetectable
4x3mB-3bryA:
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.
3cex UNCHARACTERIZED
PROTEIN


(Enterococcus
faecalis)
PF04978
(DUF664)
5 LEU A  11
ILE A  56
LEU A 114
VAL A 112
THR A 115
None
0.95A 4x3mB-3cexA:
undetectable
4x3mB-3cexA:
21.79
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.
3cf4 ACETYL-COA
DECARBOXYLASE/SYNTHA
SE ALPHA SUBUNIT


(Methanosarcina
barkeri)
PF03063
(Prismane)
5 LEU A 245
ILE A 340
MET A 375
LEU A 384
VAL A 386
None
1.04A 4x3mB-3cf4A:
3.2
4x3mB-3cf4A:
17.10
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.
3cru GLUTATHIONE
S-TRANSFERASE
CLASS-MU 26 KDA
ISOZYME


(Schistosoma
japonicum)
PF02798
(GST_N)
PF14497
(GST_C_3)
5 LEU A   5
GLY A   6
ILE A  75
VAL A  14
THR A  17
None
1.15A 4x3mB-3cruA:
undetectable
4x3mB-3cruA:
24.07
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.
3dcm UNCHARACTERIZED
PROTEIN TM_1570


(Thermotoga
maritima)
PF09936
(Methyltrn_RNA_4)
5 LEU X 140
GLY X 141
ILE X 161
LEU X 170
VAL X 172
SAM  X5452 (-4.5A)
SAM  X5452 (-3.1A)
SAM  X5452 (-3.7A)
SAM  X5452 (-4.2A)
SAM  X5452 (-3.7A)
0.96A 4x3mB-3dcmX:
12.9
4x3mB-3dcmX:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3etn PUTATIVE
PHOSPHOSUGAR
ISOMERASE INVOLVED
IN CAPSULE FORMATION


(Bacteroides
fragilis)
PF01380
(SIS)
5 LEU A 130
GLY A  98
LEU A 106
VAL A 104
THR A 107
None
1.26A 4x3mB-3etnA:
undetectable
4x3mB-3etnA:
22.34
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.
3gyq RRNA
(ADENOSINE-2'-O-)-ME
THYLTRANSFERASE


(Streptomyces
cyaneus)
PF00588
(SpoU_methylase)
PF04705
(TSNR_N)
5 GLY A 218
ILE A 238
MET A 240
LEU A 247
VAL A 249
SAM  A 270 (-2.9A)
SAM  A 270 (-3.5A)
SAM  A 270 (-3.5A)
SAM  A 270 (-4.4A)
SAM  A 270 ( 4.2A)
0.62A 4x3mB-3gyqA:
22.9
4x3mB-3gyqA:
29.23
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.
3gyq RRNA
(ADENOSINE-2'-O-)-ME
THYLTRANSFERASE


(Streptomyces
cyaneus)
PF00588
(SpoU_methylase)
PF04705
(TSNR_N)
5 ILE A 238
MET A 240
SER A 246
LEU A 247
VAL A 249
SAM  A 270 (-3.5A)
SAM  A 270 (-3.5A)
SAM  A 270 (-2.8A)
SAM  A 270 (-4.4A)
SAM  A 270 ( 4.2A)
0.78A 4x3mB-3gyqA:
22.9
4x3mB-3gyqA:
29.23
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.
3l8u PUTATIVE RRNA
METHYLASE


(Streptococcus
mutans)
PF00588
(SpoU_methylase)
5 GLY A 117
ILE A 138
SER A 147
LEU A 148
THR A 153
None
0.59A 4x3mB-3l8uA:
17.2
4x3mB-3l8uA:
23.95
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.
3lpz GET4 (YOR164C
HOMOLOG)


(Chaetomium
thermophilum)
PF04190
(DUF410)
5 LEU A  70
GLY A  67
ILE A  50
LEU A  12
THR A  31
None
1.11A 4x3mB-3lpzA:
undetectable
4x3mB-3lpzA:
23.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nip 3-GUANIDINOPROPIONAS
E


(Pseudomonas
aeruginosa)
PF00491
(Arginase)
5 LEU A 268
ILE A 209
LEU A 217
VAL A 219
THR A 222
None
0.71A 4x3mB-3nipA:
undetectable
4x3mB-3nipA:
26.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3nk7 23S RRNA
METHYLTRANSFERASE


(Streptomyces
actuosus)
PF00588
(SpoU_methylase)
PF04705
(TSNR_N)
6 GLY A 218
ILE A 238
MET A 240
SER A 246
LEU A 247
VAL A 249
SAM  A 770 (-3.0A)
SAM  A 770 (-3.8A)
SAM  A 770 (-3.3A)
SAM  A 770 (-3.9A)
SAM  A 770 (-4.5A)
SAM  A 770 (-3.7A)
0.57A 4x3mB-3nk7A:
24.8
4x3mB-3nk7A:
30.21
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.
3p2c PUTATIVE GLYCOSYL
HYDROLASE


(Bacteroides
ovatus)
PF06824
(Glyco_hydro_125)
5 LEU A 195
GLY A 118
ILE A 208
LEU A 143
VAL A 141
None
1.16A 4x3mB-3p2cA:
undetectable
4x3mB-3p2cA:
20.93
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.
3qnq PTS SYSTEM,
CELLOBIOSE-SPECIFIC
IIC COMPONENT


(Bacillus cereus)
PF02378
(PTS_EIIC)
5 LEU A 106
GLY A 190
ILE A 152
VAL A 194
THR A 110
None
1.22A 4x3mB-3qnqA:
undetectable
4x3mB-3qnqA:
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.
3rp2 RAT MAST CELL
PROTEASE II


(Rattus rattus)
PF00089
(Trypsin)
5 PRO A 198
LEU A  33
ILE A 212
LEU A  53
THR A  54
None
1.21A 4x3mB-3rp2A:
undetectable
4x3mB-3rp2A:
22.34
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.
3s9b VIPERA RUSSELLI
PROTEINASE RVV-V
GAMMA


(Daboia
siamensis)
PF00089
(Trypsin)
5 PRO A 198
LEU A  33
ILE A 212
LEU A  53
THR A  54
None
1.16A 4x3mB-3s9bA:
undetectable
4x3mB-3s9bA:
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.
3t1p ALPHA-1-ANTITRYPSIN

(Homo sapiens)
PF00079
(Serpin)
5 LEU A 306
GLY A 307
ILE A  57
MET A 351
LEU A 299
None
1.19A 4x3mB-3t1pA:
undetectable
4x3mB-3t1pA:
21.74
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.
3t2n SERINE PROTEASE
HEPSIN


(Homo sapiens)
PF00089
(Trypsin)
PF09272
(Hepsin-SRCR)
5 PRO A 356
LEU A 180
ILE A 374
LEU A 199
THR A 200
None
1.25A 4x3mB-3t2nA:
undetectable
4x3mB-3t2nA:
25.66
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.
3ulk KETOL-ACID
REDUCTOISOMERASE


(Escherichia
coli)
PF01450
(IlvC)
PF07991
(IlvN)
5 LEU A 235
GLY A 232
ILE A 295
LEU A 431
VAL A 429
LEU  A 235 ( 0.5A)
GLY  A 232 ( 0.0A)
ILE  A 295 ( 0.6A)
LEU  A 431 ( 0.6A)
VAL  A 429 ( 0.6A)
1.01A 4x3mB-3ulkA:
undetectable
4x3mB-3ulkA:
21.57
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.
3v10 RHUSIOPATHIAE
SURFACE PROTEIN B


(Erysipelothrix
rhusiopathiae)
PF05737
(Collagen_bind)
5 LEU A 168
GLY A 169
ILE A 178
SER A  86
LEU A  92
None
1.10A 4x3mB-3v10A:
undetectable
4x3mB-3v10A:
23.05
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.
3vk9 GLUTATHIONE
S-TRANSFERASE DELTA


(Bombyx mori)
PF13417
(GST_N_3)
PF14497
(GST_C_3)
5 LEU A  74
SER A 160
LEU A 159
VAL A  17
THR A  20
None
1.14A 4x3mB-3vk9A:
undetectable
4x3mB-3vk9A:
23.60
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.
3zg8 PENICILLIN-BINDING
PROTEIN 4


(Listeria
monocytogenes)
PF00905
(Transpeptidase)
PF00912
(Transgly)
5 LEU B 484
GLY B 485
ILE B 461
LEU B 457
VAL B 455
None
1.03A 4x3mB-3zg8B:
undetectable
4x3mB-3zg8B:
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.
3zg8 PENICILLIN-BINDING
PROTEIN 4


(Listeria
monocytogenes)
PF00905
(Transpeptidase)
PF00912
(Transgly)
6 PRO B 392
LEU B 486
GLY B 485
ILE B 475
MET B 500
LEU B 399
None
1.43A 4x3mB-3zg8B:
undetectable
4x3mB-3zg8B:
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.
3zgb PHOSPHOENOLPYRUVATE
CARBOXYLASE


(Flaveria
pringlei)
PF00311
(PEPcase)
5 LEU A  79
GLY A  80
LEU A 895
VAL A 897
THR A 894
None
1.09A 4x3mB-3zgbA:
undetectable
4x3mB-3zgbA:
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.
4bf7 ARABINOGALACTAN
ENDO-1,4-BETA-GALACT
OSIDASE A


(Aspergillus
nidulans)
PF07745
(Glyco_hydro_53)
5 LEU A  80
SER A 168
LEU A 115
VAL A 117
THR A 114
None
1.23A 4x3mB-4bf7A:
2.3
4x3mB-4bf7A:
22.67
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.
4bl3 PENICILLIN BINDING
PROTEIN 2 PRIME


(Staphylococcus
aureus)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF05223
(MecA_N)
5 LEU A 408
ILE A 618
MET A 628
SER A 536
LEU A 532
None
1.15A 4x3mB-4bl3A:
undetectable
4x3mB-4bl3A:
17.64
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.
4bxw FACTOR XA

(Pseudonaja
textilis)
PF00089
(Trypsin)
PF14670
(FXa_inhibition)
5 PRO A 365
LEU A 187
ILE A 379
LEU A 207
THR A 208
None
1.21A 4x3mB-4bxwA:
undetectable
4x3mB-4bxwA:
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.
4hvn HYPOTHETICAL PROTEIN

(Catenulispora
acidiphila)
PF12680
(SnoaL_2)
5 PRO A   4
GLY A  72
ILE A   6
LEU A 100
THR A 102
None
1.19A 4x3mB-4hvnA:
undetectable
4x3mB-4hvnA:
19.85
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.
4ilq CT771

(Chlamydia
trachomatis)
PF00293
(NUDIX)
5 PRO A  14
GLY A  67
ILE A  31
VAL A  61
THR A  64
None
1.26A 4x3mB-4ilqA:
undetectable
4x3mB-4ilqA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jos ADENOSYLHOMOCYSTEINE
NUCLEOSIDASE


(Francisella
philomiragia)
PF01048
(PNP_UDP_1)
5 LEU A   7
GLY A   8
ILE A  62
LEU A  58
THR A  59
None
1.19A 4x3mB-4josA:
undetectable
4x3mB-4josA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lk4 VESB PROTEASE

(Vibrio cholerae)
PF00089
(Trypsin)
5 PRO A 224
LEU A  50
ILE A 236
LEU A  74
THR A  75
None
1.21A 4x3mB-4lk4A:
undetectable
4x3mB-4lk4A:
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.
4m7f FIBRINOGEN C
DOMAIN-CONTAINING
PROTEIN 1


(Homo sapiens)
PF00147
(Fibrinogen_C)
5 LEU A 354
GLY A 353
ILE A 454
LEU A 323
THR A 324
None
1.17A 4x3mB-4m7fA:
undetectable
4x3mB-4m7fA:
19.92
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.
4mgg MUCONATE LACTONIZING
ENZYME


(Labrenzia
aggregata)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 LEU A 112
GLY A  46
ILE A  87
MET A  91
LEU A  76
None
1.26A 4x3mB-4mggA:
undetectable
4x3mB-4mggA:
24.24
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.
4nvt TRIOSEPHOSPHATE
ISOMERASE


(Brucella
melitensis)
PF00121
(TIM)
5 LEU A  65
GLY A  66
ILE A  28
SER A 238
VAL A  46
None
1.22A 4x3mB-4nvtA:
3.4
4x3mB-4nvtA:
25.26
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.
4pg6 HOMOSERINE
DEHYDROGENASE


(Staphylococcus
aureus)
PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3)
5 LEU A 158
GLY A 156
ILE A 208
SER A 213
LEU A 212
None
1.18A 4x3mB-4pg6A:
4.4
4x3mB-4pg6A:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pzk TRNA
(CYTIDINE(34)-2'-O)-
METHYLTRANSFERASE


(Bacillus
anthracis)
PF00588
(SpoU_methylase)
6 GLY A 104
ILE A 125
MET A 127
SER A 133
LEU A 134
THR A 139
SAH  A 201 (-3.1A)
SAH  A 201 (-3.9A)
SAH  A 201 (-3.3A)
SAH  A 201 ( 3.8A)
SAH  A 201 (-4.2A)
SAH  A 201 (-3.6A)
0.70A 4x3mB-4pzkA:
17.2
4x3mB-4pzkA:
25.27
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.
4qmg STAPHYLOCOCCAL
NUCLEASE
DOMAIN-CONTAINING
PROTEIN 1


(Homo sapiens)
PF00565
(SNase)
5 GLY A 307
ILE A 226
SER A 224
LEU A 223
THR A 285
None
1.26A 4x3mB-4qmgA:
undetectable
4x3mB-4qmgA:
23.60
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.
4wr4 GLUTATHIONE
S-TRANSFERASE
CLASS-MU 26 KDA
ISOZYME


(Schistosoma
japonicum)
PF02798
(GST_N)
PF14497
(GST_C_3)
5 LEU A   4
GLY A   5
ILE A  74
VAL A  13
THR A  16
BYR  A  57 ( 4.4A)
BYR  A  32 ( 4.5A)
BYR  A  73 ( 4.3A)
None
None
1.15A 4x3mB-4wr4A:
undetectable
4x3mB-4wr4A:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yji ARYL ACYLAMIDASE

(bacterium
CSBL00001)
PF01425
(Amidase)
5 PRO A 177
LEU A 128
ILE A 175
VAL A  31
THR A  34
None
1.22A 4x3mB-4yjiA:
undetectable
4x3mB-4yjiA:
22.94
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.
4yle PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR


(Burkholderia
multivorans)
PF13407
(Peripla_BP_4)
5 LEU A 157
GLY A 154
MET A 217
LEU A 227
VAL A 254
None
1.09A 4x3mB-4yleA:
4.4
4x3mB-4yleA:
23.71
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.
5anb EUKARYOTIC
TRANSLATION
INITIATION FACTOR 6


(Dictyostelium
discoideum)
PF01912
(eIF-6)
5 LEU I  81
ILE I  97
SER I  63
LEU I  71
VAL I  94
None
1.26A 4x3mB-5anbI:
undetectable
4x3mB-5anbI:
25.09
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.
5chs RNA-DIRECTED RNA
POLYMERASE L


(Indiana
vesiculovirus)
PF00946
(Mononeg_RNA_pol)
5 LEU A 297
ILE A 351
LEU A 347
VAL A 345
THR A 348
None
1.16A 4x3mB-5chsA:
undetectable
4x3mB-5chsA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cju ISOBUTYRYL-COA
MUTASE FUSED


(Cupriavidus
metallidurans)
PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK)
5 GLY A 648
ILE A 687
MET A 690
LEU A1075
THR A 631
None
1.26A 4x3mB-5cjuA:
undetectable
4x3mB-5cjuA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5co4 PUTATIVE TRNA
(CYTIDINE(34)-2'-O)-
METHYLTRANSFERASE


(Thermus
thermophilus)
no annotation 5 GLY B 101
ILE B 120
MET B 122
SER B 128
LEU B 129
MTA  B 401 (-3.2A)
MTA  B 401 (-3.7A)
MTA  B 401 (-3.4A)
MTA  B 401 ( 3.9A)
MTA  B 401 (-4.3A)
0.55A 4x3mB-5co4B:
18.0
4x3mB-5co4B:
26.34
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.
5do7 ATP-BINDING CASSETTE
SUB-FAMILY G MEMBER
8


(Homo sapiens)
PF00005
(ABC_tran)
PF01061
(ABC2_membrane)
5 LEU B 534
ILE B 646
SER B 651
LEU B 650
VAL B 538
None
1.20A 4x3mB-5do7B:
undetectable
4x3mB-5do7B:
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.
5fdn PHOSPHOENOLPYRUVATE
CARBOXYLASE 3


(Arabidopsis
thaliana)
PF00311
(PEPcase)
5 LEU A  79
GLY A  80
LEU A 898
VAL A 900
THR A 897
None
1.21A 4x3mB-5fdnA:
undetectable
4x3mB-5fdnA:
15.70
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.
5gvt PLASMA KALLIKREIN

(Mus musculus)
no annotation 5 PRO A 198
LEU A  33
ILE A 212
LEU A  53
THR A  54
None
1.24A 4x3mB-5gvtA:
undetectable
4x3mB-5gvtA:
15.60
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.
5ic9 PUTATIVE
UNCHARACTERIZED
PROTEIN


(Chaetomium
thermophilum)
PF04003
(Utp12)
5 LEU A 906
ILE A 877
LEU A 873
VAL A 871
THR A 874
None
1.23A 4x3mB-5ic9A:
undetectable
4x3mB-5ic9A:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ixd TYROSINE-PROTEIN
KINASE JAK1


(Homo sapiens)
no annotation 5 LEU A 155
MET A 202
SER A 262
LEU A 266
VAL A 268
None
1.11A 4x3mB-5ixdA:
undetectable
4x3mB-5ixdA:
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.
5jtk UNCHARACTERIZED
PROTEIN


(Pseudomonas
aeruginosa)
no annotation 5 PRO A   3
LEU A  51
GLY A  86
ILE A   7
VAL A  40
None
0.98A 4x3mB-5jtkA:
undetectable
4x3mB-5jtkA:
18.08
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.
5jxu DYP-TYPE PEROXIDASE
FAMILY


(Thermomonospora
curvata)
PF04261
(Dyp_perox)
5 LEU A 143
GLY A 142
ILE A 387
LEU A 251
VAL A 384
None
1.06A 4x3mB-5jxuA:
undetectable
4x3mB-5jxuA:
23.77
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.
5ks1 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE


(Vibrio
vulnificus)
PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C)
5 LEU A 284
ILE A   6
LEU A  18
VAL A  20
THR A  17
None
1.16A 4x3mB-5ks1A:
2.3
4x3mB-5ks1A:
24.36
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.
5lta PRE-MRNA-SPLICING
FACTOR ATP-DEPENDENT
RNA HELICASE PRP43


(Chaetomium
thermophilum)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind)
5 LEU A 518
GLY A 519
ILE A 637
LEU A 535
VAL A 533
None
1.06A 4x3mB-5ltaA:
undetectable
4x3mB-5ltaA:
18.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n1x B-CELL LYMPHOMA 6
PROTEIN


(Homo sapiens)
PF00651
(BTB)
5 PRO D  80
LEU D  86
ILE D  78
VAL D 105
THR D 108
None
1.10A 4x3mB-5n1xD:
undetectable
4x3mB-5n1xD:
19.23
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.
5n72 WIPA

(Legionella
pneumophila)
no annotation 5 LEU A 178
GLY A 394
ILE A 276
LEU A 287
VAL A 392
None
1.05A 4x3mB-5n72A:
undetectable
4x3mB-5n72A:
20.15
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.
5thz CURJ

(Moorea
producens)
no annotation 5 LEU B  39
GLY B  36
ILE B 317
LEU B 168
THR B 131
None
1.20A 4x3mB-5thzB:
undetectable
4x3mB-5thzB:
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.
5tov ADENOSYLHOMOCYSTEINA
SE


(Thermotoga
maritima)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
5 LEU A 147
GLY A 143
ILE A 111
SER A  39
LEU A 118
None
1.12A 4x3mB-5tovA:
2.2
4x3mB-5tovA:
22.87
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.
5tov ADENOSYLHOMOCYSTEINA
SE


(Thermotoga
maritima)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
5 LEU A 147
ILE A 111
LEU A 118
VAL A 120
THR A 119
None
1.22A 4x3mB-5tovA:
2.2
4x3mB-5tovA:
22.87
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.
5u7z ACID CERAMIDASE

(Homo sapiens)
no annotation 5 LEU B 307
GLY B 291
ILE B 349
MET B 354
VAL B 316
None
1.13A 4x3mB-5u7zB:
undetectable
4x3mB-5u7zB:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u84 ACID CERAMIDASE

(Balaenoptera
acutorostrata)
no annotation 5 LEU A 307
GLY A 291
ILE A 349
MET A 354
VAL A 316
None
None
None
None
IOD  A 417 ( 4.2A)
1.17A 4x3mB-5u84A:
undetectable
4x3mB-5u84A:
11.72
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.
5ucy TUBULIN ALPHA CHAIN

(Tetrahymena
thermophila)
PF00091
(Tubulin)
PF03953
(Tubulin_C)
5 LEU A 149
GLY A 111
ILE A  93
LEU A 117
VAL A 115
None
1.15A 4x3mB-5ucyA:
undetectable
4x3mB-5ucyA:
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.
5w1e PUTATIVE
TRANSCRIPTIONAL
REGULATOR


(Streptomyces
coelicolor)
no annotation 5 GLY A 150
ILE A 123
SER A 111
LEU A 112
VAL A 234
None
None
PHB  A 602 (-2.5A)
None
None
1.11A 4x3mB-5w1eA:
undetectable
4x3mB-5w1eA:
16.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wno RECEPTOR
TYROSINE-PROTEIN
KINASE LET-23


(Caenorhabditis
elegans)
no annotation 5 LEU A1137
GLY A1133
ILE A 994
LEU A1011
VAL A1070
None
1.14A 4x3mB-5wnoA:
undetectable
4x3mB-5wnoA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xd7 3,6-ANHYDRO-ALPHA-L-
GALACTONATE
CYCLOISOMERASE


(Vibrio sp. EJY3)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 LEU A 115
GLY A  47
ILE A  84
MET A  88
LEU A  73
None
1.14A 4x3mB-5xd7A:
undetectable
4x3mB-5xd7A:
23.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xxi CYTOCHROME P450 2C9

(Homo sapiens)
no annotation 5 LEU A 445
GLY A 442
ILE A 359
LEU A 361
THR A 305
None
None
None
None
HEM  A 504 (-3.9A)
0.85A 4x3mB-5xxiA:
undetectable
4x3mB-5xxiA:
18.53
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.
5xxi CYTOCHROME P450 2C9

(Homo sapiens)
no annotation 5 PRO A 427
LEU A 445
GLY A 442
LEU A 361
THR A 305
None
None
None
None
HEM  A 504 (-3.9A)
1.20A 4x3mB-5xxiA:
undetectable
4x3mB-5xxiA:
18.53
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.
5xyi RIBOSOMAL PROTEIN
S13P/S18E, PUTATIVE


(Trichomonas
vaginalis)
PF00416
(Ribosomal_S13)
5 LEU S 105
GLY S 106
ILE S  35
SER S  19
LEU S  18
None
1.21A 4x3mB-5xyiS:
undetectable
4x3mB-5xyiS:
23.44
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.
5yb7 L-AMINO ACID
OXIDASE/MONOOXYGENAS
E


(Pseudomonas sp.
AIU 813)
no annotation 5 PRO A 277
LEU A 117
MET A  65
SER A 288
LEU A 289
None
1.17A 4x3mB-5yb7A:
undetectable
4x3mB-5yb7A:
13.75