SIMILAR PATTERNS OF AMINO ACIDS FOR 2BM9_F_SAMF301

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.
1dgj ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
desulfuricans) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		5 GLY A 622
ARG A 565
ALA A 874
HIS A 876
ALA A 878
 None
 1.03A 2bm9F-1dgjA:
undetectable		 2bm9F-1dgjA:
13.72
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.
1o2d ALCOHOL
DEHYDROGENASE,
IRON-CONTAINING

(Thermotoga
maritima) 		PF00465
(Fe-ADH) 		5 GLY A  96
GLY A 187
ALA A 190
HIS A 193
ALA A 243
 NAP  A1800 (-3.3A)
None
None
FE  A 900 ( 3.4A)
None
 0.98A 2bm9F-1o2dA:
2.7		 2bm9F-1o2dA:
20.49
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.
1o2d ALCOHOL
DEHYDROGENASE,
IRON-CONTAINING

(Thermotoga
maritima) 		PF00465
(Fe-ADH) 		5 GLY A 275
LEU A 278
GLY A 197
ALA A 194
ALA A 214
 None
 1.05A 2bm9F-1o2dA:
2.7		 2bm9F-1o2dA:
20.49
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.
1o2d ALCOHOL
DEHYDROGENASE,
IRON-CONTAINING

(Thermotoga
maritima) 		PF00465
(Fe-ADH) 		5 GLY A 275
LEU A 278
GLY A 197
ALA A 194
ASP A 189
 None
None
None
None
FE  A 900 ( 2.5A)
 0.95A 2bm9F-1o2dA:
2.7		 2bm9F-1o2dA:
20.49
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.
1o9g RRNA
METHYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF11599
(AviRa) 		6 GLY A  70
LEU A  71
LEU A 138
GLY A 104
ALA A  98
ALA A  94
 None
 1.26A 2bm9F-1o9gA:
7.9		 2bm9F-1o9gA:
24.57
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.
1oy0 KETOPANTOATE
HYDROXYMETHYLTRANSFE
RASE

(Mycobacterium
tuberculosis) 		PF02548
(Pantoate_transf) 		5 GLY A  92
GLY A 125
ALA A 127
HIS A 128
ALA A 129
 None
 0.91A 2bm9F-1oy0A:
undetectable		 2bm9F-1oy0A:
23.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pwe L-SERINE DEHYDRATASE

(Rattus
norvegicus) 		PF00291
(PALP) 		5 GLY A 168
GLY A  66
CYH A  62
ASN A  67
ALA A  68
 None
 1.01A 2bm9F-1pweA:
2.6		 2bm9F-1pweA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q18 GLUCOKINASE

(Escherichia
coli) 		PF02685
(Glucokinase) 		5 GLY A 140
GLY A 305
ASP A   9
CYH A  60
ALA A 103
 None
 0.89A 2bm9F-1q18A:
undetectable		 2bm9F-1q18A:
19.19
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.
1rrm LACTALDEHYDE
REDUCTASE

(Escherichia
coli) 		PF00465
(Fe-ADH) 		5 GLY A  97
GLY A 194
ALA A 197
HIS A 200
ALA A 250
 APR  A 389 (-3.1A)
None
None
ZN  A 387 ( 3.3A)
None
 1.02A 2bm9F-1rrmA:
undetectable		 2bm9F-1rrmA:
22.70
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.
1rrm LACTALDEHYDE
REDUCTASE

(Escherichia
coli) 		PF00465
(Fe-ADH) 		5 GLY A  98
GLY A 194
ALA A 197
HIS A 200
ALA A 250
 APR  A 389 (-3.2A)
None
None
ZN  A 387 ( 3.3A)
None
 0.84A 2bm9F-1rrmA:
undetectable		 2bm9F-1rrmA:
22.70
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.
1w5e FTSZ

(Methanocaldococcus
jannaschii) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLY A 221
GLY A 230
ALA A 321
ALA A 300
ASP A 324
 None
 1.07A 2bm9F-1w5eA:
undetectable		 2bm9F-1w5eA:
19.53
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.
1ys5 LIPOPROTEIN

(Neisseria
meningitidis) 		PF08794
(Lipoprot_C) 		5 GLY A 137
LEU A 152
GLY A  80
ASN A  79
ALA A  51
 None
 1.02A 2bm9F-1ys5A:
undetectable		 2bm9F-1ys5A:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zoi ESTERASE

(Pseudomonas
putida) 		PF00561
(Abhydrolase_1) 		5 GLY A  59
GLY A  99
HIS A  55
ALA A  54
ASP A  78
 None
 1.02A 2bm9F-1zoiA:
undetectable		 2bm9F-1zoiA:
21.43
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.
2a4e CADHERIN-11

(Mus musculus) 		PF00028
(Cadherin) 		5 GLY A 194
GLY A 139
ASP A  98
ASN A 140
ALA A 142
 None
None
CA  A 302 (-3.1A)
None
None
 1.08A 2bm9F-2a4eA:
undetectable		 2bm9F-2a4eA:
20.70
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.
2a8i THREONINE ASPARTASE
1

(Homo sapiens) 		PF01112
(Asparaginase_2) 		5 GLY A 294
LEU A 255
GLY A 230
ASN A 100
ALA A  48
 None
 1.03A 2bm9F-2a8iA:
undetectable		 2bm9F-2a8iA:
19.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2br4 CEPHALOSPORIN
HYDROXYLASE CMCI

(Streptomyces
clavuligerus) 		PF04989
(CmcI) 		6 ASP A 116
ARG A 117
CYH A 139
ALA A 161
HIS A 162
ALA A 163
 SAM  A 301 (-3.0A)
SAM  A 301 (-3.7A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.6A)
MG  A 300 ( 4.4A)
SAM  A 301 ( 3.7A)
 0.97A 2bm9F-2br4A:
32.9		 2bm9F-2br4A:
99.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2br4 CEPHALOSPORIN
HYDROXYLASE CMCI

(Streptomyces
clavuligerus) 		PF04989
(CmcI) 		9 GLY A  17
LEU A  18
LEU A  64
GLY A  89
ASP A 116
ALA A 161
HIS A 162
ALA A 163
ASP A 187
 P4C  A 500 (-4.0A)
SAM  A 301 ( 4.4A)
SAM  A 301 (-4.2A)
SAM  A 301 (-3.3A)
SAM  A 301 (-3.0A)
SAM  A 301 (-3.6A)
MG  A 300 ( 4.4A)
SAM  A 301 ( 3.7A)
MG  A 300 (-3.3A)
 0.64A 2bm9F-2br4A:
32.9		 2bm9F-2br4A:
99.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2br4 CEPHALOSPORIN
HYDROXYLASE CMCI

(Streptomyces
clavuligerus) 		PF04989
(CmcI) 		8 GLY A  17
LEU A  64
ASP A 116
CYH A 139
ALA A 161
HIS A 162
ALA A 163
ASP A 187
 P4C  A 500 (-4.0A)
SAM  A 301 (-4.2A)
SAM  A 301 (-3.0A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.6A)
MG  A 300 ( 4.4A)
SAM  A 301 ( 3.7A)
MG  A 300 (-3.3A)
 0.78A 2bm9F-2br4A:
32.9		 2bm9F-2br4A:
99.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2br4 CEPHALOSPORIN
HYDROXYLASE CMCI

(Streptomyces
clavuligerus) 		PF04989
(CmcI) 		6 GLY A  89
ASP A 116
ARG A 117
ALA A 161
HIS A 162
ALA A 163
 SAM  A 301 (-3.3A)
SAM  A 301 (-3.0A)
SAM  A 301 (-3.7A)
SAM  A 301 (-3.6A)
MG  A 300 ( 4.4A)
SAM  A 301 ( 3.7A)
 0.79A 2bm9F-2br4A:
32.9		 2bm9F-2br4A:
99.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2br4 CEPHALOSPORIN
HYDROXYLASE CMCI

(Streptomyces
clavuligerus) 		PF04989
(CmcI) 		6 LEU A  64
GLY A  89
ASP A 116
ARG A 117
ALA A 161
HIS A 162
 SAM  A 301 (-4.2A)
SAM  A 301 (-3.3A)
SAM  A 301 (-3.0A)
SAM  A 301 (-3.7A)
SAM  A 301 (-3.6A)
MG  A 300 ( 4.4A)
 1.21A 2bm9F-2br4A:
32.9		 2bm9F-2br4A:
99.15
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.
2c4t 5'-FLUORO-5'-DEOXYAD
ENOSINE SYNTHASE

(Streptomyces
cattleya) 		PF01887
(SAM_adeno_trans) 		5 GLY A 231
LEU A 250
LEU A 225
GLY A 271
ALA A  99
 None
 1.06A 2bm9F-2c4tA:
undetectable		 2bm9F-2c4tA:
23.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d4y FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 1

(Salmonella
enterica) 		no annotation 5 GLY A 455
LEU A 458
GLY A 323
ALA A 431
ASP A 451
 None
 1.04A 2bm9F-2d4yA:
undetectable		 2bm9F-2d4yA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eae ALPHA-FUCOSIDASE

(Bifidobacterium
bifidum) 		PF14498
(Glyco_hyd_65N_2) 		5 GLY A 126
GLY A 454
ALA A 482
HIS A 483
ALA A 506
 None
 1.05A 2bm9F-2eaeA:
undetectable		 2bm9F-2eaeA:
13.02
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.
2gn1 THREONINE
DEHYDRATASE
CATABOLIC

(Salmonella
enterica) 		PF00291
(PALP) 		5 GLY A  55
GLY A 237
ASP A 236
ALA A 284
ALA A 286
 None
LLP  A  58 ( 4.4A)
None
LLP  A  58 ( 3.4A)
None
 1.03A 2bm9F-2gn1A:
3.5		 2bm9F-2gn1A:
20.69
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.
2hk0 D-PSICOSE
3-EPIMERASE

(Agrobacterium
tumefaciens) 		PF01261
(AP_endonuc_2) 		5 GLY A 288
LEU A 287
GLY A 219
ALA A 279
ALA A 276
 GLY  A 288 ( 0.0A)
LEU  A 287 ( 0.6A)
GLY  A 219 ( 0.0A)
ALA  A 279 ( 0.0A)
ALA  A 276 ( 0.0A)
 0.95A 2bm9F-2hk0A:
undetectable		 2bm9F-2hk0A:
20.19
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.
2ihw LIPOAMIDE
ACYLTRANSFERASE
COMPONENT OF
BRANCHED-CHAIN
ALPHA-KETO ACID
DEHYDROGENASE
COMPLEX

(Bos taurus) 		PF00198
(2-oxoacid_dh) 		5 GLY A 320
LEU A 325
LEU A 316
GLY A 284
ALA A 286
 None
None
None
None
ACT  A 600 ( 4.5A)
 1.07A 2bm9F-2ihwA:
undetectable		 2bm9F-2ihwA:
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.
2nlx XYLULOSE KINASE

(Escherichia
coli) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 GLY A   8
GLY A 230
ASP A 167
ALA A 236
ALA A 238
 None
 1.01A 2bm9F-2nlxA:
undetectable		 2bm9F-2nlxA:
19.58
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.
2ogx MOLYBDENUM STORAGE
PROTEIN SUBUNIT
ALPHA

(Azotobacter
vinelandii) 		PF00696
(AA_kinase) 		5 GLY A 149
GLY A  48
ASN A 112
ALA A  80
ALA A 105
 None
ATP  A 281 (-3.8A)
None
ATP  A 281 (-3.6A)
None
 1.08A 2bm9F-2ogxA:
2.6		 2bm9F-2ogxA:
21.99
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.
2pge MENC

(Desulfotalea
psychrophila) 		PF13378
(MR_MLE_C) 		5 LEU A  81
LEU A  85
GLY A  44
ALA A 128
ALA A 124
 None
 0.99A 2bm9F-2pgeA:
undetectable		 2bm9F-2pgeA:
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.
2r5g CHLORIDE
INTRACELLULAR
CHANNEL PROTEIN 2

(Homo sapiens) 		PF13409
(GST_N_2)
PF13410
(GST_C_2) 		5 GLY A 211
LEU A 150
ASP A 183
ALA A 219
ALA A 221
 None
 0.99A 2bm9F-2r5gA:
undetectable		 2bm9F-2r5gA:
22.03
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.
2vc2 INTEGRIN ALPHA-IIB

(Homo sapiens) 		PF01839
(FG-GAP)
PF13517
(VCBS) 		5 LEU A   3
LEU A 366
GLY A 423
ALA A 361
ALA A 359
 None
 1.08A 2bm9F-2vc2A:
undetectable		 2bm9F-2vc2A:
18.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vrk ALPHA-L-ARABINOFURAN
OSIDASE

(Thermobacillus
xylanilyticus) 		PF06964
(Alpha-L-AF_C) 		5 GLY A 182
GLY A 128
ARG A  69
ASN A 129
ALA A  76
 None
 0.90A 2bm9F-2vrkA:
undetectable		 2bm9F-2vrkA:
19.76
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.
2yeq ALKALINE PHOSPHATASE
D

(Bacillus
subtilis) 		PF09423
(PhoD)
PF16655
(PhoD_N) 		5 GLY A  16
LEU A  25
GLY A 102
ALA A 200
ALA A 197
 None
None
PE5  A 530 ( 4.7A)
PE5  A 530 ( 3.9A)
PE5  A 530 (-4.1A)
 0.98A 2bm9F-2yeqA:
undetectable		 2bm9F-2yeqA:
16.95
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.
2z3t CYTOCHROME P450

(Streptomyces
sp. TP-A0274) 		PF00067
(p450) 		7 GLY A 377
LEU A 263
LEU A 156
GLY A 255
CYH A 364
ALA A 370
ALA A 367
 None
None
None
HEM  A 500 (-3.6A)
HEM  A 500 (-2.5A)
HEM  A 500 (-3.6A)
None
 1.47A 2bm9F-2z3tA:
undetectable		 2bm9F-2z3tA:
21.60
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.
3aqo PROBABLE SECDF
PROTEIN-EXPORT
MEMBRANE PROTEIN

(Thermus
thermophilus) 		no annotation 5 GLY A 108
LEU A 250
GLY A 248
ALA A 242
ASP A 209
 None
 1.03A 2bm9F-3aqoA:
undetectable		 2bm9F-3aqoA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bfj 1,3-PROPANEDIOL
OXIDOREDUCTASE

(Klebsiella
pneumoniae) 		PF00465
(Fe-ADH) 		5 GLY A 102
GLY A 196
ALA A 199
HIS A 202
ALA A 254
 None
None
None
FE2  A1388 (-3.4A)
None
 0.97A 2bm9F-3bfjA:
undetectable		 2bm9F-3bfjA:
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.
3dla GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		5 LEU A 651
LEU A 483
GLY A 648
ARG A 285
ASP A 568
 None
 1.02A 2bm9F-3dlaA:
undetectable		 2bm9F-3dlaA:
17.38
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.
3e39 PUTATIVE
NITROREDUCTASE

(Desulfovibrio
alaskensis) 		PF00881
(Nitroreductase) 		5 GLY A  37
CYH A  49
ASN A 106
ALA A 103
ALA A 100
 None
 0.91A 2bm9F-3e39A:
undetectable		 2bm9F-3e39A:
21.60
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.
3g4e REGUCALCIN

(Homo sapiens) 		PF08450
(SGL) 		5 GLY A 271
LEU A 272
GLY A 279
ALA A 263
ASP A 243
 None
 0.93A 2bm9F-3g4eA:
undetectable		 2bm9F-3g4eA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g4e REGUCALCIN

(Homo sapiens) 		PF08450
(SGL) 		5 GLY A 271
LEU A 272
GLY A 279
ARG A  15
ASP A 243
 None
 0.94A 2bm9F-3g4eA:
undetectable		 2bm9F-3g4eA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g6e 50S RIBOSOMAL
PROTEIN L13P

(Haloarcula
marismortui) 		PF00572
(Ribosomal_L13) 		5 GLY J  77
LEU J 132
GLY J  20
ALA J  23
ALA J  27
 None
None
A  01242 ( 3.1A)
None
C  01103 ( 3.3A)
 0.94A 2bm9F-3g6eJ:
undetectable		 2bm9F-3g6eJ:
18.93
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.
3h0l GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Aquifex
aeolicus) 		PF01425
(Amidase) 		5 LEU A 220
LEU A 459
ALA A 431
ALA A 424
ASP A 454
 None
 0.96A 2bm9F-3h0lA:
undetectable		 2bm9F-3h0lA:
19.20
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.
3h74 PYRIDOXAL KINASE

(Lactobacillus
plantarum) 		PF08543
(Phos_pyr_kin) 		5 GLY A 206
GLY A 210
ASN A 209
ALA A 260
ASP A 255
 None
 1.02A 2bm9F-3h74A:
undetectable		 2bm9F-3h74A:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hb7 ISOCHORISMATASE
HYDROLASE

(Alkaliphilus
metalliredigens) 		PF00857
(Isochorismatase) 		5 LEU A 147
GLY A 123
CYH A  24
ALA A 152
HIS A 159
 None
 0.90A 2bm9F-3hb7A:
2.8		 2bm9F-3hb7A:
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.
3hl0 MALEYLACETATE
REDUCTASE

(Agrobacterium
fabrum) 		PF00465
(Fe-ADH) 		5 GLY A  95
GLY A 168
ASN A 170
ALA A 171
HIS A 174
 NAD  A 402 (-3.2A)
None
NAD  A 402 ( 4.4A)
None
None
 0.95A 2bm9F-3hl0A:
2.4		 2bm9F-3hl0A:
21.43
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.
3hl0 MALEYLACETATE
REDUCTASE

(Agrobacterium
fabrum) 		PF00465
(Fe-ADH) 		5 GLY A 168
ASN A 170
ALA A 171
HIS A 174
ALA A 175
 None
NAD  A 402 ( 4.4A)
None
None
None
 1.04A 2bm9F-3hl0A:
2.4		 2bm9F-3hl0A:
21.43
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.
3hut PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC TRANSPORTER

(Rhodospirillum
rubrum) 		PF13458
(Peripla_BP_6) 		5 GLY A 111
LEU A  43
LEU A 113
GLY A 323
ALA A 327
 None
 1.08A 2bm9F-3hutA:
3.9		 2bm9F-3hutA:
22.44
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.
3ikm DNA POLYMERASE
SUBUNIT GAMMA-1

(Homo sapiens) 		PF00476
(DNA_pol_A) 		5 GLY A 928
LEU A 931
GLY A 917
ALA A 915
ALA A 899
 None
 1.06A 2bm9F-3ikmA:
undetectable		 2bm9F-3ikmA:
11.09
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.
3khj INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE

(Cryptosporidium
parvum) 		PF00478
(IMPDH) 		5 GLY A 208
LEU A  35
GLY A 138
ALA A 149
ASP A 186
 None
 1.05A 2bm9F-3khjA:
undetectable		 2bm9F-3khjA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kkw PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF00583
(Acetyltransf_1) 		5 GLY A  63
LEU A  96
GLY A  51
ALA A  45
ASP A  12
 None
None
EDO  A 178 (-3.9A)
EDO  A 170 ( 3.7A)
None
 1.06A 2bm9F-3kkwA:
undetectable		 2bm9F-3kkwA:
22.00
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.
3lsc TRIAZINE HYDROLASE

(Paenarthrobacter
aurescens) 		PF01979
(Amidohydro_1) 		5 LEU A 335
LEU A 339
GLY A 321
ALA A 294
ALA A 273
 None
 1.06A 2bm9F-3lscA:
undetectable		 2bm9F-3lscA:
18.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ocd SOXX

(Starkeya
novella) 		PF00034
(Cytochrom_C) 		5 GLY B 139
GLY B 123
ASN B 124
ALA B 105
ALA B 102
 None
HEC  B 401 (-3.6A)
None
None
None
 1.07A 2bm9F-3ocdB:
undetectable		 2bm9F-3ocdB:
21.83
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.
3pnn CONSERVED DOMAIN
PROTEIN

(Porphyromonas
gingivalis) 		no annotation 5 GLY A  26
LEU A 286
GLY A 272
ALA A 120
ASP A  23
 None
None
GOL  A 303 ( 4.0A)
None
GOL  A 301 (-3.5A)
 1.05A 2bm9F-3pnnA:
undetectable		 2bm9F-3pnnA:
22.44
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.
3s29 SUCROSE SYNTHASE 1

(Arabidopsis
thaliana) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 GLY A 418
ASP A 417
ASN A 414
HIS A 438
ALA A 439
 None
None
None
None
FRU  A 902 ( 3.7A)
 1.03A 2bm9F-3s29A:
undetectable		 2bm9F-3s29A:
15.00
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.
3swl CHLORIDE
INTRACELLULAR
CHANNEL PROTEIN 1

(Homo sapiens) 		PF13409
(GST_N_2)
PF13410
(GST_C_2) 		5 GLY A 205
LEU A 144
ASP A 177
ALA A 213
ALA A 215
 None
 1.06A 2bm9F-3swlA:
undetectable		 2bm9F-3swlA:
22.14
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.
3u9r METHYLCROTONYL-COA
CARBOXYLASE,
BETA-SUBUNIT

(Pseudomonas
aeruginosa) 		PF01039
(Carboxyl_trans) 		5 GLY B 118
ASP B 137
ARG B  84
ALA B 116
ALA B 102
 None
 1.06A 2bm9F-3u9rB:
undetectable		 2bm9F-3u9rB:
17.84
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.
3uqe 6-PHOSPHOFRUCTOKINAS
E ISOZYME 2

(Escherichia
coli) 		PF00294
(PfkB) 		5 LEU A 183
GLY A 279
CYH A 295
ALA A 261
ALA A  47
 None
 1.05A 2bm9F-3uqeA:
3.1		 2bm9F-3uqeA:
24.06
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.
3ut2 CATALASE-PEROXIDASE
2

(Magnaporthe
oryzae) 		PF00141
(peroxidase) 		5 LEU A 564
LEU A 511
GLY A 590
ALA A 520
ALA A 524
 None
 1.02A 2bm9F-3ut2A:
undetectable		 2bm9F-3ut2A:
15.45
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.
3uw2 PHOSPHOGLUCOMUTASE/P
HOSPHOMANNOMUTASE
FAMILY PROTEIN

(Burkholderia
thailandensis) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 GLY A  83
GLY A 244
ASP A 243
ALA A 185
ALA A 189
 None
None
ZN  A 474 ( 2.5A)
None
None
 1.02A 2bm9F-3uw2A:
undetectable		 2bm9F-3uw2A:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vov GLUCOKINASE

(Thermus
thermophilus) 		PF00480
(ROK) 		5 GLY A 144
LEU A 295
GLY A 288
ALA A 110
ALA A 108
 None
 1.01A 2bm9F-3vovA:
undetectable		 2bm9F-3vovA:
21.43
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.
3wjp HYDROGENASE
EXPRESSION/FORMATION
PROTEIN HYPE

(Thermococcus
kodakarensis) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLY A  60
GLY A 131
ASN A  97
ALA A  96
ALA A  94
 None
 1.02A 2bm9F-3wjpA:
undetectable		 2bm9F-3wjpA:
21.87
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.
4asy GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E

(Pseudomonas
aeruginosa) 		PF00483
(NTP_transferase) 		5 LEU A  88
LEU A 106
GLY A 109
ASP A 110
ALA A   9
 None
 1.07A 2bm9F-4asyA:
undetectable		 2bm9F-4asyA:
24.22
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.
4c51 CATALASE-PEROXIDASE

(Mycobacterium
tuberculosis) 		PF00141
(peroxidase) 		5 LEU A 521
LEU A 467
GLY A 548
ALA A 476
ALA A 480
 None
 1.04A 2bm9F-4c51A:
undetectable		 2bm9F-4c51A:
15.30
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.
4dgq NON-HEME
CHLOROPEROXIDASE

(Burkholderia
cenocepacia) 		PF00561
(Abhydrolase_1) 		5 GLY A  59
GLY A  99
HIS A  55
ALA A  54
ASP A  78
 None
 0.98A 2bm9F-4dgqA:
2.0		 2bm9F-4dgqA:
17.38
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.
4dyo ASPARTYL
AMINOPEPTIDASE

(Homo sapiens) 		PF02127
(Peptidase_M18) 		5 GLY A 426
LEU A 427
GLY A  87
ALA A 336
ALA A 332
 None
 0.98A 2bm9F-4dyoA:
undetectable		 2bm9F-4dyoA:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f0l AMIDOHYDROLASE

(Brucella
abortus) 		PF01979
(Amidohydro_1) 		5 GLY A  20
LEU A  16
GLY A 367
ALA A 363
ALA A 354
 None
 1.07A 2bm9F-4f0lA:
undetectable		 2bm9F-4f0lA:
20.98
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.
4f55 SPORE CORTEX-LYTIC
ENZYME

(Bacillus cereus) 		PF07486
(Hydrolase_2) 		5 GLY A 141
GLY A 222
ASN A 221
ALA A 219
ALA A 170
 None
 1.08A 2bm9F-4f55A:
undetectable		 2bm9F-4f55A:
17.55
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.
4f6t MOLYBDENUM STORAGE
PROTEIN SUBUNIT
ALPHA

(Azotobacter
vinelandii) 		PF00696
(AA_kinase) 		5 GLY A 149
GLY A  48
ASN A 112
ALA A  80
ALA A 105
 None
ATP  A 301 (-3.8A)
None
ATP  A 301 (-3.7A)
None
 1.06A 2bm9F-4f6tA:
undetectable		 2bm9F-4f6tA:
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.
4fr2 1,3-PROPANEDIOL
DEHYDROGENASE

(Oenococcus oeni) 		PF00465
(Fe-ADH) 		5 GLY A 274
LEU A 273
ASN A 360
ALA A 361
ALA A 367
 None
 1.04A 2bm9F-4fr2A:
3.0		 2bm9F-4fr2A:
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.
4fzi PROSTAGLANDIN F
SYNTHASE

(Trypanosoma
cruzi) 		PF00248
(Aldo_ket_red) 		5 GLY A  22
LEU A  21
GLY A  62
ALA A  33
ALA A  30
 None
 0.93A 2bm9F-4fziA:
undetectable		 2bm9F-4fziA:
18.60
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.
4gn8 REGUCALCIN

(Mus musculus) 		PF08450
(SGL) 		5 GLY A 271
LEU A 272
GLY A 279
ALA A 263
ASP A 243
 None
 0.86A 2bm9F-4gn8A:
undetectable		 2bm9F-4gn8A:
22.78
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.
4h0p ACETATE KINASE

(Cryptococcus
neoformans) 		PF00871
(Acetate_kinase) 		5 LEU A  83
LEU A  79
GLY A  20
ALA A  10
ALA A 421
 None
 1.08A 2bm9F-4h0pA:
undetectable		 2bm9F-4h0pA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 14

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M) 		5 GLY N 159
LEU N 161
GLY N 150
ALA N 175
ALA N 173
 None
 1.03A 2bm9F-4heaN:
undetectable		 2bm9F-4heaN:
18.39
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.
4im7 HYPOTHETICAL
OXIDOREDUCTASE YDFI

(Escherichia
coli) 		PF01232
(Mannitol_dh)
PF08125
(Mannitol_dh_C) 		5 LEU A 106
LEU A 110
GLY A 161
ASP A 149
ALA A 159
 None
None
None
None
NAI  A 502 ( 4.7A)
 1.07A 2bm9F-4im7A:
3.2		 2bm9F-4im7A:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lgl GLYCINE
DEHYDROGENASE
[DECARBOXYLATING]

(Synechocystis
sp. PCC 6803) 		PF02347
(GDC-P) 		5 GLY A 371
LEU A 375
GLY A 292
ALA A 363
ALA A 360
 None
 0.96A 2bm9F-4lglA:
2.4		 2bm9F-4lglA:
13.24
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.
4m8d PUTATIVE
UNCHARACTERIZED
PROTEIN

(Labrenzia
aggregata) 		PF04199
(Cyclase) 		5 GLY A 191
LEU A 223
GLY A 251
ALA A  80
HIS A 216
 None
 1.00A 2bm9F-4m8dA:
undetectable		 2bm9F-4m8dA:
21.90
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.
4pza GLUCOSYL-3-PHOSPHOGL
YCERATE PHOSPHATASE

(Mycobacterium
tuberculosis) 		PF00300
(His_Phos_1) 		5 GLY A 160
GLY A  12
ASN A 186
ALA A 187
ALA A 216
 PO4  A 601 (-3.5A)
None
None
None
None
 0.99A 2bm9F-4pzaA:
undetectable		 2bm9F-4pzaA:
23.53
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.
4rbn SUCROSE
SYNTHASE:GLYCOSYL
TRANSFERASES GROUP 1

(Nitrosomonas
europaea) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		6 GLY A 405
ASP A 404
ARG A 369
ASN A 401
HIS A 425
ALA A 426
 None
 1.35A 2bm9F-4rbnA:
2.6		 2bm9F-4rbnA:
15.24
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.
4u98 MALTOKINASE

(Mycolicibacterium
vanbaalenii) 		PF01636
(APH) 		5 LEU A 292
LEU A 447
GLY A 403
ASP A 402
ALA A 345
 None
 1.04A 2bm9F-4u98A:
undetectable		 2bm9F-4u98A:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wgx MOLINATE HYDROLASE

(Gulosibacter
molinativorax) 		PF01979
(Amidohydro_1) 		5 GLY A  61
GLY A 367
ASP A 369
ALA A 102
ALA A  99
 None
 1.07A 2bm9F-4wgxA:
undetectable		 2bm9F-4wgxA:
18.20
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.
4wrr PUTATIVE
DIACYLGLYCEROL
KINASE

(Bacillus
anthracis) 		PF00781
(DAGK_cat) 		5 GLY A 202
LEU A 205
GLY A 141
CYH A 282
ALA A 131
 None
 1.04A 2bm9F-4wrrA:
2.3		 2bm9F-4wrrA:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ahk ACETOLACTATE
SYNTHASE II, LARGE
SUBUNIT

(Pseudomonas
protegens) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		6 LEU A 126
LEU A 121
GLY A  77
ALA A  72
ALA A  70
ASP A 165
 None
 1.42A 2bm9F-5ahkA:
3.0		 2bm9F-5ahkA:
16.72
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.
5bp1 MYCOCEROSIC ACID
SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A  32
LEU A  28
GLY A 358
ALA A 362
ALA A 410
 None
 1.03A 2bm9F-5bp1A:
undetectable		 2bm9F-5bp1A:
13.44
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.
5fhz ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3

(Homo sapiens) 		PF00171
(Aldedh) 		5 GLY A 282
LEU A 439
GLY A 486
ASN A 485
ALA A 254
 NAD  A 601 (-3.7A)
None
None
None
None
 0.99A 2bm9F-5fhzA:
3.1		 2bm9F-5fhzA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5idt GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E

(Burkholderia
vietnamiensis) 		PF00483
(NTP_transferase) 		5 LEU A  89
LEU A 107
GLY A 110
ASP A 111
ALA A  10
 None
None
None
THM  A 301 (-3.1A)
None
 1.07A 2bm9F-5idtA:
undetectable		 2bm9F-5idtA:
20.74
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.
5jo9 RIBITOL
2-DEHYDROGENASE

(Bradyrhizobium
japonicum) 		PF00106
(adh_short) 		5 LEU A 190
GLY A  14
ASP A  38
ASN A  88
ALA A  89
 PO4  A 301 (-4.4A)
PO4  A 301 (-4.5A)
None
PO4  A 301 (-3.4A)
None
 0.87A 2bm9F-5jo9A:
5.8		 2bm9F-5jo9A:
20.00
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.
5khn RND TRANSPORTER

(Burkholderia
multivorans) 		no annotation 5 LEU B 845
LEU B 849
ASP B 344
ALA B 787
ALA B 384
 None
 1.05A 2bm9F-5khnB:
undetectable		 2bm9F-5khnB:
13.76
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.
5o2d POLY [ADP-RIBOSE]
POLYMERASE 14

(Homo sapiens) 		no annotation 5 LEU A1164
LEU A1014
ALA A1128
HIS A1168
ALA A1026
 None
 1.08A 2bm9F-5o2dA:
undetectable		 2bm9F-5o2dA:
21.25
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.
5odr METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
G
METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
A

(Methanothermococcus
thermolithotrophicus;
Methanothermococcus
thermolithotrophicus) 		PF01058
(Oxidored_q6)
PF00374
(NiFeSe_Hases) 		5 GLY E  95
LEU E 289
GLY E 282
ASP E 279
ALA F  53
 None
 0.95A 2bm9F-5odrE:
undetectable		 2bm9F-5odrE:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5teg N-LYSINE
METHYLTRANSFERASE
KMT5A

(Homo sapiens) 		PF00856
(SET) 		5 GLY A 229
LEU A 293
GLY A 217
ALA A 232
ALA A 327
 None
 1.07A 2bm9F-5tegA:
undetectable		 2bm9F-5tegA:
19.58
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.
5tt0 OXIDOREDUCTASE,
SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY

(Burkholderia
thailandensis) 		PF13561
(adh_short_C2) 		5 GLY A  11
ASP A  35
ASN A  81
ALA A  82
ALA A 108
 SO4  A 301 ( 3.7A)
EDO  A 305 (-3.5A)
None
EDO  A 305 ( 3.6A)
None
 0.83A 2bm9F-5tt0A:
undetectable		 2bm9F-5tt0A:
23.57
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.
5vdb ACETYLTRANSFERASE
PA4794

(Pseudomonas
aeruginosa) 		PF00583
(Acetyltransf_1) 		5 GLY A  63
LEU A  96
GLY A  51
ALA A  45
ASP A  12
 None
None
SO4  A 201 (-3.4A)
None
None
 1.05A 2bm9F-5vdbA:
undetectable		 2bm9F-5vdbA:
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.
5wbl REGULATORY-ASSOCIATE
D PROTEIN OF TOR 1

(Arabidopsis
thaliana) 		no annotation 5 GLY A 968
GLY A 621
CYH A 594
ALA A 568
ASP A 576
 None
 1.08A 2bm9F-5wblA:
3.3		 2bm9F-5wblA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xnl OXYGEN-EVOLVING
ENHANCER PROTEIN 1,
CHLOROPLASTIC

(Pisum sativum) 		PF01716
(MSP) 		5 GLY O  44
GLY O  91
ASN O  47
ALA O  48
ALA O 244
 None
 0.88A 2bm9F-5xnlO:
undetectable		 2bm9F-5xnlO:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xww AMPHB

(Streptomyces
nodosus) 		no annotation 5 GLY A 400
GLY A 225
ARG A 251
ALA A 306
ALA A 329
 NAP  A 501 (-3.2A)
NAP  A 501 (-3.6A)
NAP  A 501 (-3.6A)
NAP  A 501 (-3.5A)
NAP  A 501 ( 3.7A)
 1.07A 2bm9F-5xwwA:
2.2		 2bm9F-5xwwA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6azt ASPARAGINYL
ENDOPEPTIDASE 1

(Helianthus
annuus) 		no annotation 6 GLY A 185
GLY A  70
ASP A 104
ASN A  73
HIS A  76
ALA A  78
 SNN  A 177 ( 3.2A)
None
None
None
SNN  A 177 ( 3.3A)
None
 1.41A 2bm9F-6aztA:
undetectable		 2bm9F-6aztA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d6q EXOSOME COMPLEX
COMPONENT RRP42

(Homo sapiens) 		no annotation 5 LEU E 192
GLY E  47
ASN E 162
ALA E 159
ALA E 155
 None
 0.94A 2bm9F-6d6qE:
undetectable		 2bm9F-6d6qE:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dg4 ULP1-LIKE SUMO
PROTEASE

(Chaetomium
thermophilum) 		no annotation 5 GLY A 216
LEU A 215
ALA A  73
ALA A  91
ASP A 126
 None
 0.98A 2bm9F-6dg4A:
undetectable		 2bm9F-6dg4A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6esq HYDROXYMETHYLGLUTARY
L-COA SYNTHASE

(Methanothermococcus
thermolithotrophicus) 		no annotation 5 GLY I  75
LEU I 127
GLY I 120
ALA I 138
ALA I 162
 None
 1.00A 2bm9F-6esqI:
undetectable		 2bm9F-6esqI:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f34 AMINO ACID
TRANSPORTER

(Geobacillus
kaustophilus) 		no annotation 5 LEU A 372
GLY A  50
ALA A  52
HIS A  56
ALA A  57
 None
 1.04A 2bm9F-6f34A:
undetectable		 2bm9F-6f34A:
undetectable