SIMILAR PATTERNS OF AMINO ACIDS FOR 4UCK_B_SAMB2409_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dqp GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Giardia
intestinalis) 		PF00156
(Pribosyltran) 		5 GLY A 185
GLY A 194
ASP A 125
ALA A  45
THR A  48
 None
 1.09A 4uckB-1dqpA:
2.5		 4uckB-1dqpA:
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.
1kwg BETA-GALACTOSIDASE

(Thermus
thermophilus) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 GLY A 482
TRP A 570
SER A 485
LEU A 461
ALA A 408
 None
 0.99A 4uckB-1kwgA:
undetectable		 4uckB-1kwgA:
19.09
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.
1ne2 HYPOTHETICAL PROTEIN
TA1320

(Thermoplasma
acidophilum) 		PF06325
(PrmA) 		5 GLY A 143
ASN A 144
ASP A  54
ALA A 132
THR A 135
 None
 1.15A 4uckB-1ne2A:
7.0		 4uckB-1ne2A:
17.75
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.
1pgv TROPOMODULIN TMD-1

(Caenorhabditis
elegans) 		no annotation 5 GLY A 337
ASN A 338
LEU A 305
ASP A 279
ALA A 328
 None
 1.04A 4uckB-1pgvA:
undetectable		 4uckB-1pgvA:
18.70
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.
1r5j PUTATIVE
PHOSPHOTRANSACETYLAS
E

(Streptococcus
pyogenes) 		PF01515
(PTA_PTB) 		5 GLY A 298
LEU A 182
ALA A 228
THR A 225
ALA A 186
 None
 1.14A 4uckB-1r5jA:
undetectable		 4uckB-1r5jA:
22.97
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.
1ud3 AMYLASE

(Bacillus sp.
KSM-K38) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 THR A 469
GLY A 428
GLY A 471
ASN A 470
ALA A 295
 None
 1.09A 4uckB-1ud3A:
undetectable		 4uckB-1ud3A:
20.48
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.
1ym5 HYPOTHETICAL 32.6
KDA PROTEIN IN
DAP2-SLT2 INTERGENIC
REGION

(Saccharomyces
cerevisiae) 		PF02567
(PhzC-PhzF) 		5 THR A 158
GLY A 228
GLY A 230
THR A  54
ALA A  80
 None
 1.11A 4uckB-1ym5A:
undetectable		 4uckB-1ym5A:
21.23
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.
1zxx 6-PHOSPHOFRUCTOKINAS
E

(Lactobacillus
delbrueckii) 		PF00365
(PFK) 		5 THR A   8
GLY A  11
GLY A  10
ALA A 142
THR A 145
 None
 1.15A 4uckB-1zxxA:
undetectable		 4uckB-1zxxA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		5 THR A  51
GLY A 204
ASP A 774
ALA A 781
THR A 782
 FMT  A1798 ( 4.6A)
FMT  A1798 (-3.7A)
None
None
None
 1.12A 4uckB-2c4mA:
undetectable		 4uckB-2c4mA:
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.
2di8 FILAMIN-B

(Homo sapiens) 		PF00630
(Filamin) 		5 GLY A  40
GLY A   7
ASP A  35
THR A  82
ALA A  11
 None
 1.13A 4uckB-2di8A:
undetectable		 4uckB-2di8A:
14.53
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.
2ewy BETA-SECRETASE 2

(Homo sapiens) 		PF00026
(Asp) 		5 GLY A  50
GLY A 136
ASN A  53
ALA A 347
THR A 348
 DBO  A1001 (-3.7A)
None
None
None
None
 1.13A 4uckB-2ewyA:
undetectable		 4uckB-2ewyA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gep SULFITE REDUCTASE
HEMOPROTEIN

(Escherichia
coli) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 GLY A 484
GLY A 482
ASN A 481
ALA A 394
THR A 393
 None
SF4  A 575 (-4.2A)
SRM  A 580 ( 3.5A)
None
None
 1.01A 4uckB-2gepA:
undetectable		 4uckB-2gepA:
21.40
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.
2ii1 ACETAMIDASE

(Bacillus
halodurans) 		PF03069
(FmdA_AmdA) 		5 THR A 281
GLY A 152
GLY A 149
LEU A 179
THR A  33
 None
 1.04A 4uckB-2ii1A:
undetectable		 4uckB-2ii1A:
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.
2ivf ETHYLBENZENE
DEHYDROGENASE
ALPHA-SUBUNIT

(Aromatoleum
aromaticum) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 GLY A 774
GLY A 776
SER A 772
LEU A 771
THR A 768
 None
None
ACT  A1983 (-4.7A)
None
MES  A1977 (-4.9A)
 1.04A 4uckB-2ivfA:
undetectable		 4uckB-2ivfA:
16.68
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.
2iz7 MOCO CARRIER PROTEIN

(Chlamydomonas
reinhardtii) 		no annotation 5 THR A  64
GLY A  44
GLY A  66
LEU A  47
THR A  18
 None
 1.15A 4uckB-2iz7A:
undetectable		 4uckB-2iz7A:
16.63
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.
2j6h GLUCOSAMINE-FRUCTOSE
-6-PHOSPHATE
AMINOTRANSFERASE

(Escherichia
coli) 		PF01380
(SIS)
PF13522
(GATase_6) 		5 THR A 124
GLY A 157
SER A 176
ALA A 353
THR A 352
 ONL  A1609 (-4.3A)
None
None
None
G6Q  A1610 (-3.1A)
 1.16A 4uckB-2j6hA:
undetectable		 4uckB-2j6hA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nyu PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2

(Homo sapiens) 		PF01728
(FtsJ) 		5 GLY A  34
TRP A  36
LEU A  63
THR A  81
LYS A 144
 SAM  A 201 (-3.7A)
SAM  A 201 (-3.9A)
SAM  A 201 (-4.2A)
SAM  A 201 ( 4.1A)
SAM  A 201 (-3.5A)
 1.01A 4uckB-2nyuA:
9.1		 4uckB-2nyuA:
17.11
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.
2o1x 1-DEOXY-D-XYLULOSE-5
-PHOSPHATE SYNTHASE

(Deinococcus
radiodurans) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
PF13292
(DXP_synthase_N) 		5 GLY A 155
GLY A 153
ASN A 181
ASP A 368
ALA A 193
 TDP  A1001 (-3.6A)
TDP  A1001 (-3.2A)
None
None
None
 1.14A 4uckB-2o1xA:
undetectable		 4uckB-2o1xA:
18.38
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.
2pfk 6-PHOSPHOFRUCTOKINAS
E ISOZYME I

(Escherichia
coli) 		PF00365
(PFK) 		5 THR A   8
GLY A  11
GLY A  10
ALA A 142
THR A 145
 None
 1.14A 4uckB-2pfkA:
undetectable		 4uckB-2pfkA:
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.
2uxt PROTEIN SUFI

(Escherichia
coli) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLY A 206
GLY A 205
SER A 239
ASP A 188
ALA A 274
 None
 1.13A 4uckB-2uxtA:
undetectable		 4uckB-2uxtA:
21.33
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.
2wa2 NON-STRUCTURAL
PROTEIN 5

(Modoc virus) 		PF01728
(FtsJ) 		5 GLY A  84
GLY A  86
LEU A 106
THR A 134
LYS A 184
 SAM  A1248 (-3.4A)
SAM  A1248 (-4.4A)
SAM  A1248 (-4.1A)
SAM  A1248 (-3.8A)
None
 0.96A 4uckB-2wa2A:
9.7		 4uckB-2wa2A:
21.21
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.
2xt0 HALOALKANE
DEHALOGENASE

(Plesiocystis
pacifica) 		PF00561
(Abhydrolase_1) 		5 GLY A 157
GLY A 159
SER A 155
LEU A 154
ALA A 151
 None
 1.06A 4uckB-2xt0A:
undetectable		 4uckB-2xt0A:
20.85
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.
3dh9 THIOREDOXIN
REDUCTASE 1

(Drosophila
melanogaster) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 208
GLY A 210
SER A  72
LEU A  73
ALA A  77
 None
 1.13A 4uckB-3dh9A:
undetectable		 4uckB-3dh9A:
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.
3hz6 XYLULOKINASE

(Chromobacterium
violaceum) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		6 GLY A  79
GLY A  11
SER A  78
LEU A 239
ASP A 174
ALA A 245
 None
 1.47A 4uckB-3hz6A:
undetectable		 4uckB-3hz6A:
22.33
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.
3io1 AMINOBENZOYL-GLUTAMA
TE UTILIZATION
PROTEIN

(Klebsiella
pneumoniae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 THR A 228
GLY A 373
ASP A 151
ALA A 206
ALA A 377
 None
None
NA  A 501 (-2.0A)
None
None
 1.07A 4uckB-3io1A:
undetectable		 4uckB-3io1A:
21.27
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.
3ld3 INORGANIC
PYROPHOSPHATASE

(Anaplasma
phagocytophilum) 		PF00719
(Pyrophosphatase) 		5 THR A  62
GLY A   9
GLY A   7
ASN A  61
ALA A 111
 None
 1.14A 4uckB-3ld3A:
undetectable		 4uckB-3ld3A:
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.
3mg9 TEG12

(uncultured soil
bacterium) 		PF00685
(Sulfotransfer_1) 		5 GLY A 140
GLY A 127
ASN A 123
ASP A  71
ALA A   8
 None
 1.02A 4uckB-3mg9A:
undetectable		 4uckB-3mg9A:
22.95
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.
3mgb TEG12

(uncultured soil
bacterium) 		PF00685
(Sulfotransfer_1) 		5 GLY A 140
GLY A 127
ASN A 123
ASP A  71
ALA A   8
 None
 0.97A 4uckB-3mgbA:
undetectable		 4uckB-3mgbA:
22.76
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.
3mml ALLOPHANATE
HYDROLASE SUBUNIT 2
ALLOPHANATE
HYDROLASE SUBUNIT 1

(Mycolicibacterium
smegmatis;
Mycolicibacterium
smegmatis) 		PF02626
(CT_A_B)
PF02682
(CT_C_D) 		5 GLY A  28
GLY B 131
ASP B  41
ALA B  45
THR B  48
 None
 1.11A 4uckB-3mmlA:
undetectable		 4uckB-3mmlA:
19.17
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.
3mtw L-ARGININE
CARBOXYPEPTIDASE
CC2672

(Caulobacter
vibrioides) 		PF01979
(Amidohydro_1) 		5 GLY A 288
ASP A 277
ALA A 253
THR A 215
ALA A 262
 None
 1.11A 4uckB-3mtwA:
undetectable		 4uckB-3mtwA:
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.
3pl2 SUGAR KINASE,
RIBOKINASE FAMILY

(Corynebacterium
glutamicum) 		PF00294
(PfkB) 		5 GLY A  54
ASN A  56
ASP A 308
ALA A 290
THR A 289
 None
 1.14A 4uckB-3pl2A:
undetectable		 4uckB-3pl2A:
19.64
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.
3rim TRANSKETOLASE

(Mycobacterium
tuberculosis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 THR A 485
GLY A 461
ALA A 188
THR A 185
ALA A 446
 None
 1.09A 4uckB-3rimA:
3.0		 4uckB-3rimA:
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.
3s2g ZINC-CONTAINING
ALCOHOL
DEHYDROGENASE
SUPERFAMILY

(Cupriavidus
pinatubonensis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 THR A 156
GLY A 265
ASN A 264
LEU A  46
ALA A  48
 None
 1.02A 4uckB-3s2gA:
3.4		 4uckB-3s2gA:
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.
3s2g ZINC-CONTAINING
ALCOHOL
DEHYDROGENASE
SUPERFAMILY

(Cupriavidus
pinatubonensis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 THR A 311
GLY A 181
GLY A 179
ALA A 216
ALA A 208
 None
None
SO4  A 701 (-3.0A)
None
None
 1.11A 4uckB-3s2gA:
3.4		 4uckB-3s2gA:
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.
3tkk PREDICTED
ACETAMIDASE/FORMAMID
ASE

(Caldanaerobacter
subterraneus) 		PF03069
(FmdA_AmdA) 		5 THR A 282
GLY A 153
GLY A 150
LEU A 180
THR A  34
 None
 0.92A 4uckB-3tkkA:
undetectable		 4uckB-3tkkA:
21.55
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.
3tts BETA-GALACTOSIDASE

(Bacillus
circulans) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 THR A 341
GLY A  13
GLY A  12
TRP A  10
THR A  80
 None
 1.01A 4uckB-3ttsA:
undetectable		 4uckB-3ttsA:
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.
3txv PROBABLE TAGATOSE
6-PHOSPHATE KINASE

(Sinorhizobium
meliloti) 		PF08013
(Tagatose_6_P_K) 		5 GLY A 289
GLY A 291
ASP A  94
THR A  64
ALA A  29
 None
 1.15A 4uckB-3txvA:
undetectable		 4uckB-3txvA:
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.
3umm PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE

(Salmonella
enterica) 		PF02769
(AIRS_C)
PF13507
(GATase_5) 		5 GLY A 507
ASN A 510
TRP A 543
LEU A 439
ALA A 575
 None
 1.06A 4uckB-3ummA:
undetectable		 4uckB-3ummA:
14.78
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.
3vcn MANNONATE
DEHYDRATASE

(Caulobacter
vibrioides) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 311
GLY A 337
ASP A 238
ALA A 271
ALA A 285
 None
None
MG  A 501 ( 4.6A)
None
None
 1.16A 4uckB-3vcnA:
undetectable		 4uckB-3vcnA:
20.82
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.
3wqy ALANINE--TRNA LIGASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF02272
(DHHA1)
PF07973
(tRNA_SAD) 		5 THR A 582
GLY A 555
GLY A 554
ASN A 553
ALA A 576
 None
 1.06A 4uckB-3wqyA:
undetectable		 4uckB-3wqyA:
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.
3x0y DSZC

(Rhodococcus
erythropolis) 		PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
PF08028
(Acyl-CoA_dh_2) 		5 GLY A  91
ASN A 260
ALA A  35
THR A  34
ALA A  86
 None
 1.02A 4uckB-3x0yA:
undetectable		 4uckB-3x0yA:
21.72
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.
3x43 O-UREIDO-L-SERINE
SYNTHASE

(Streptomyces
lavendulae) 		PF00291
(PALP) 		6 THR A 300
GLY A 263
GLY A 294
ALA A 271
THR A 272
ALA A 247
 None
 1.44A 4uckB-3x43A:
undetectable		 4uckB-3x43A:
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.
4cp8 ALLOPHANATE
HYDROLASE

(Pseudomonas sp.
ADP) 		PF01425
(Amidase) 		5 THR A 390
GLY A 190
GLY A 188
SER A 225
ALA A 238
 None
None
MLI  A1466 (-4.0A)
None
None
 0.91A 4uckB-4cp8A:
undetectable		 4uckB-4cp8A:
19.84
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.
4eb0 LCC

(uncultured
bacterium) 		PF12695
(Abhydrolase_5) 		5 GLY A 163
LEU A 172
ALA A 175
THR A 198
ALA A 184
 None
 1.08A 4uckB-4eb0A:
undetectable		 4uckB-4eb0A:
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.
4emk U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM6

(Schizosaccharomyces
pombe) 		PF01423
(LSM) 		5 GLY B  64
ASN B  65
LEU B  18
ASP B  26
ALA B  72
 None
 1.08A 4uckB-4emkB:
undetectable		 4uckB-4emkB:
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.
4g38 SULFITE REDUCTASE
[NADPH] HEMOPROTEIN
BETA-COMPONENT

(Escherichia
coli) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 GLY A 484
GLY A 482
ASN A 481
ALA A 394
THR A 393
 None
SF4  A 603 ( 4.3A)
SRM  A 604 ( 3.4A)
None
None
 1.04A 4uckB-4g38A:
undetectable		 4uckB-4g38A:
20.48
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.
4h2k SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20) 		5 THR A 236
GLY A  97
GLY A  95
LEU A 105
ALA A 107
 None
 1.08A 4uckB-4h2kA:
undetectable		 4uckB-4h2kA:
19.71
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.
4hxy PLM1

(Streptomyces
sp. HK803) 		PF08659
(KR) 		5 GLY A 192
GLY A 194
LEU A 214
ALA A 240
THR A 239
 None
NDP  A 501 (-3.4A)
None
None
None
 0.97A 4uckB-4hxyA:
3.5		 4uckB-4hxyA:
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.
4i4i 6-PHOSPHOFRUCTOKINAS
E

(Geobacillus
stearothermophilus) 		PF00365
(PFK) 		5 THR A   8
GLY A  11
GLY A  10
ALA A 142
THR A 145
 None
 1.16A 4uckB-4i4iA:
undetectable		 4uckB-4i4iA:
21.81
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.
4izo PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Burkholderia
thailandensis) 		PF02222
(ATP-grasp) 		5 GLY A 224
SER A 228
LEU A 229
ALA A 390
THR A 387
 None
 1.05A 4uckB-4izoA:
3.0		 4uckB-4izoA:
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.
4jcc IRON-COMPOUND ABC
TRANSPORTER,
IRON-COMPOUND-BINDIN
G PROTEIN

(Streptococcus
pneumoniae) 		PF01497
(Peripla_BP_2) 		5 THR A 154
GLY A  66
ASN A 157
SER A 302
THR A 295
 None
 1.05A 4uckB-4jccA:
undetectable		 4uckB-4jccA:
23.00
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.
4jso OLIGOPEPTIDE ABC
TRANSPORTER,
PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		5 GLY A 102
GLY A 104
LEU A  23
ASP A  33
ALA A  90
 None
None
BGC  A 605 (-4.6A)
CA  A 606 ( 3.4A)
None
 1.10A 4uckB-4jsoA:
undetectable		 4uckB-4jsoA:
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.
4lb0 UNCHARACTERIZED
PROTEIN

(Agrobacterium
vitis) 		PF05544
(Pro_racemase) 		5 GLY A 256
GLY A  94
ASN A  96
ALA A 264
THR A 265
 ACT  A 401 (-3.6A)
ACT  A 401 (-3.6A)
None
None
None
 1.15A 4uckB-4lb0A:
undetectable		 4uckB-4lb0A:
20.96
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.
4mkm PUTATIVE SURFACE
ANCHORED PROTEIN

(Clostridium
perfringens) 		no annotation 5 GLY A 236
ASN A 235
LEU A 240
ASP A 190
THR A 225
 None
 1.16A 4uckB-4mkmA:
undetectable		 4uckB-4mkmA:
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.
4n49 CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1

(Homo sapiens) 		PF01728
(FtsJ) 		5 GLY A 279
GLY A 281
LEU A 302
THR A 337
LYS A 404
 SAM  A 601 (-3.5A)
SAM  A 601 (-3.6A)
SAM  A 601 (-4.1A)
SAM  A 601 ( 3.9A)
SAM  A 601 ( 4.1A)
 0.79A 4uckB-4n49A:
12.2		 4uckB-4n49A:
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.
4pfw ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		5 GLY A 279
ASN A 432
LEU A 317
ALA A 315
ALA A 515
 None
 1.00A 4uckB-4pfwA:
undetectable		 4uckB-4pfwA:
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.
4pfw ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		5 THR A 547
GLY A 540
SER A  33
LEU A  34
ALA A 542
 None
None
None
None
BMA  A 605 ( 4.4A)
 1.11A 4uckB-4pfwA:
undetectable		 4uckB-4pfwA:
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.
4ppm AMINOTRANSFERASE

(Serratia sp.
FS14) 		PF00202
(Aminotran_3) 		5 GLY A 443
GLY A 441
SER A 646
LEU A 622
ALA A 694
 None
 1.03A 4uckB-4ppmA:
undetectable		 4uckB-4ppmA:
18.13
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.
4qdi UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE

(Acinetobacter
baumannii) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 GLY A 121
GLY A 174
ASP A 235
ALA A 299
THR A 298
 None
 0.98A 4uckB-4qdiA:
undetectable		 4uckB-4qdiA:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rfu COAT PROTEIN

(Redspotted
grouper nervous
necrosis virus) 		PF11729
(Capsid-VNN) 		5 GLY A  57
SER A  55
ASP A 104
ALA A 100
THR A  22
 None
 1.04A 4uckB-4rfuA:
undetectable		 4uckB-4rfuA:
17.08
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.
4rku PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1

(Pisum sativum) 		PF00223
(PsaA_PsaB) 		5 GLY A 516
GLY A 517
SER A 510
ALA A 507
ALA A 499
 None
None
None
CLA  A1133 ( 4.6A)
CLA  A1133 ( 3.7A)
 1.10A 4uckB-4rkuA:
undetectable		 4uckB-4rkuA:
20.59
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.
4rzp ENGINEERED PROTEIN
OR366

(synthetic
construct) 		PF00514
(Arm)
PF13646
(HEAT_2) 		5 GLY A 158
ASN A 159
LEU A 194
ALA A 235
ALA A 198
 None
 1.12A 4uckB-4rzpA:
undetectable		 4uckB-4rzpA:
20.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 10 THR A1670
GLY A1698
GLY A1700
ASN A1701
TRP A1702
LEU A1720
ALA A1756
THR A1757
ALA A1780
LYS A1817
 None
 0.55A 4uckB-4uclA:
58.7		 4uckB-4uclA:
99.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 10 THR A1670
GLY A1698
GLY A1700
ASN A1701
TRP A1702
SER A1719
LEU A1720
ALA A1756
THR A1757
LYS A1817
 None
 0.79A 4uckB-4uclA:
58.7		 4uckB-4uclA:
99.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 10 THR A1670
GLY A1700
ASN A1701
TRP A1702
LEU A1720
ASP A1722
ALA A1756
THR A1757
ALA A1780
LYS A1817
 None
 0.65A 4uckB-4uclA:
58.7		 4uckB-4uclA:
99.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 10 THR A1670
GLY A1700
ASN A1701
TRP A1702
SER A1719
LEU A1720
ASP A1722
ALA A1756
THR A1757
LYS A1817
 None
 0.85A 4uckB-4uclA:
58.7		 4uckB-4uclA:
99.76
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.
4wv3 ANTHRANILATE-COA
LIGASE

(Stigmatella
aurantiaca) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 GLY A 223
GLY A 225
LEU A 215
ALA A 266
THR A 268
 None
 0.98A 4uckB-4wv3A:
2.6		 4uckB-4wv3A:
23.24
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.
4xgn 3-HYDROXYACYL-COA
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00106
(adh_short) 		5 GLY A  42
ASN A  38
ALA A  71
THR A  72
ALA A  67
 None
 1.12A 4uckB-4xgnA:
4.2		 4uckB-4xgnA:
20.05
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.
4xyi KINETOCHORE PROTEIN
MIS16

(Schizosaccharomyces
japonicus) 		PF00400
(WD40)
PF12265
(CAF1C_H4-bd) 		5 GLY A 184
GLY A 182
ASN A 132
THR A 262
ALA A 196
 None
 1.11A 4uckB-4xyiA:
undetectable		 4uckB-4xyiA:
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.
4z6k ALCOHOL
DEHYDROGENASE

(Moraxella sp.
TAE123) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 THR A 152
GLY A 261
ASN A 260
LEU A  42
ALA A  44
 None
 1.02A 4uckB-4z6kA:
undetectable		 4uckB-4z6kA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zgv FERREDOXIN RECEPTOR

(Pectobacterium
atrosepticum) 		PF07715
(Plug) 		6 THR A 670
GLY A 120
GLY A 668
ASN A 669
SER A 117
THR A  87
 None
None
None
BOG  A 905 (-4.1A)
None
None
 1.30A 4uckB-4zgvA:
undetectable		 4uckB-4zgvA:
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.
4zv9 UNCHARACTERIZED
PROTEIN

(Escherichia
coli) 		PF01738
(DLH) 		5 GLY A 210
ASN A 237
TRP A 240
ALA A 196
ALA A 213
 CME  A 186 ( 3.4A)
None
None
None
None
 1.12A 4uckB-4zv9A:
undetectable		 4uckB-4zv9A:
20.99
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.
5da0 SULPHATE TRANSPORTER

(Deinococcus
geothermalis) 		PF00916
(Sulfate_transp)
PF01740
(STAS) 		5 THR A 253
GLY A 296
SER A 301
LEU A 300
ALA A  65
 DMU  A 602 ( 4.9A)
None
None
None
None
 1.13A 4uckB-5da0A:
undetectable		 4uckB-5da0A:
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.
5dmy BETA-GALACTOSIDASE

(Bifidobacterium
bifidum) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 GLY A 514
ASN A 516
SER A 574
THR A 634
ALA A 535
 None
None
None
NA  A 903 (-2.8A)
None
 0.95A 4uckB-5dmyA:
undetectable		 4uckB-5dmyA:
18.35
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.
5doo PROTEIN LYSINE
METHYLTRANSFERASE 2

(Rickettsia
typhi) 		PF10119
(MethyTransf_Reg)
PF13847
(Methyltransf_31) 		5 GLY A  32
GLY A  36
ASN A 304
LEU A  28
ALA A 146
 None
 1.06A 4uckB-5dooA:
7.7		 4uckB-5dooA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e2h BETA-LACTAMASE

(Mycolicibacterium
smegmatis) 		PF00144
(Beta-lactamase) 		5 GLY A 153
GLY A 150
SER A 156
ALA A  72
THR A  73
 None
 1.07A 4uckB-5e2hA:
undetectable		 4uckB-5e2hA:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ep8 PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE

(Bacillus
subtilis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 GLY A  88
GLY A  86
LEU A 251
THR A 396
LYS A 383
 GLY  A  88 ( 0.0A)
GLY  A  86 ( 0.0A)
LEU  A 251 ( 0.6A)
THR  A 396 ( 0.8A)
LYS  A 383 ( 0.0A)
 1.09A 4uckB-5ep8A:
undetectable		 4uckB-5ep8A:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f7r LMO0178 PROTEIN

(Listeria
monocytogenes) 		no annotation 5 THR E 214
GLY E 204
GLY E 206
ALA E 104
THR E 100
 None
 1.12A 4uckB-5f7rE:
undetectable		 4uckB-5f7rE:
22.72
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.
5fkr ENDO-1,4-BETA-GLUCAN
ASE/XYLOGLUCANASE,
PUTATIVE, GLY74A

(Cellvibrio
japonicus) 		no annotation 5 THR A 432
GLY A  48
GLY A  50
TRP A 413
THR A 497
 None
 1.06A 4uckB-5fkrA:
undetectable		 4uckB-5fkrA:
20.68
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.
5gly GLYCOSIDE HYDROLASE
FAMILY 45 PROTEIN

(Thielavia
terrestris) 		PF02015
(Glyco_hydro_45) 		5 GLY A 129
GLY A 149
ALA A  75
THR A 110
ALA A 124
 CTR  A 302 (-3.5A)
CTR  A 302 (-3.7A)
CTT  A 301 (-3.5A)
None
None
 1.15A 4uckB-5glyA:
undetectable		 4uckB-5glyA:
17.66
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.
5gru DIABODY PROTEIN
DIABODY PROTEIN

(Homo sapiens;
Mus musculus) 		PF07686
(V-set)
PF07686
(V-set) 		5 THR H 219
GLY H 176
LEU L 111
ALA L  92
THR L  91
 THR  H 219 ( 0.8A)
GLY  H 176 ( 0.0A)
LEU  L 111 ( 0.6A)
ALA  L  92 ( 0.0A)
THR  L  91 ( 0.8A)
 1.03A 4uckB-5gruH:
undetectable		 4uckB-5gruH:
20.75
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.
5iof SULPHATE TRANSPORTER

(Deinococcus
geothermalis) 		PF00916
(Sulfate_transp) 		5 THR A 253
GLY A 296
SER A 301
LEU A 300
ALA A  65
 None
 1.13A 4uckB-5iofA:
undetectable		 4uckB-5iofA:
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.
5jse PHIAB6 TAILSPIKE

(unidentified
phage) 		PF12708
(Pectate_lyase_3) 		5 GLY A 165
GLY A 193
LEU A 132
ASP A 104
ALA A 175
 None
 1.16A 4uckB-5jseA:
undetectable		 4uckB-5jseA:
19.03
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.
5ks8 PYRUVATE CARBOXYLASE
SUBUNIT BETA

(Methylobacillus
flagellatus) 		PF00364
(Biotin_lipoyl)
PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		5 GLY C 236
GLY C 286
LEU C 239
ASP C  13
ALA C 211
 None
None
None
MN  C2002 (-2.4A)
None
 1.15A 4uckB-5ks8C:
undetectable		 4uckB-5ks8C:
21.73
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN2

(Saccharomyces
cerevisiae) 		PF01851
(PC_rep)
PF13646
(HEAT_2) 		5 THR N 419
GLY N 451
GLY N 449
LEU N 490
THR N 727
 None
 1.11A 4uckB-5mpdN:
undetectable		 4uckB-5mpdN:
19.01
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.
5mq6 PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE-LIKE
PROTEIN

(Thermothelomyces
thermophila) 		PF07992
(Pyr_redox_2) 		5 GLY A 204
GLY A 206
LEU A  67
ALA A  69
ALA A  65
 None
 0.93A 4uckB-5mq6A:
undetectable		 4uckB-5mq6A:
19.60
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.
5nof ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE

(Thermococcus
kodakarensis) 		no annotation 5 GLY A  74
GLY A  76
ASN A 188
ASP A  71
ALA A  88
 None
ZN  A 502 ( 4.8A)
None
None
None
 1.13A 4uckB-5nofA:
undetectable		 4uckB-5nofA:
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.
5ny0 L. REUTERIS SRRP
BINDING REGION

(Lactobacillus
reuteri) 		no annotation 5 GLY A 347
GLY A 319
ASN A 318
ALA A 447
ALA A 408
 None
 0.95A 4uckB-5ny0A:
undetectable		 4uckB-5ny0A:
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.
5o3z SORBITOL-6-PHOSPHATE
DEHYDROGENASE

(Erwinia
amylovora) 		no annotation 5 GLY A  10
LEU A  34
ALA A  62
THR A  63
ALA A  89
 None
 0.87A 4uckB-5o3zA:
undetectable		 4uckB-5o3zA:
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.
5uxn PHOSPHO-2-DEHYDRO-3-
DEOXYHEPTONATE
ALDOLASE

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A  66
GLY A 107
LEU A 427
ALA A 429
LYS A  80
 None
 1.11A 4uckB-5uxnA:
undetectable		 4uckB-5uxnA:
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.
5v6c HEMOLYSIN-RELATED
PROTEIN

(Vibrio cholerae) 		no annotation 5 THR A 831
GLY A 827
GLY A 952
SER A 891
ALA A 922
 None
 0.93A 4uckB-5v6cA:
undetectable		 4uckB-5v6cA:
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.
5x6a ENDOGLUCANASE,
PUTATIVE

(Aspergillus
fumigatus) 		no annotation 5 THR A  80
GLY A  16
GLY A   6
TRP A  79
ALA A  60
 None
 1.00A 4uckB-5x6aA:
undetectable		 4uckB-5x6aA:
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.
5x7s GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE

(Paenibacillus
sp. 598K) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF16990
(CBM_35)
PF17137
(DUF5110) 		5 GLY A1170
GLY A1162
ASN A1163
THR A1243
ALA A1172
 None
None
EDO  A1804 ( 4.9A)
None
None
 1.15A 4uckB-5x7sA:
undetectable		 4uckB-5x7sA:
15.12
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.
5xjh POLY(ETHYLENE
TEREPHTHALATE)
HYDROLASE

(Ideonella
sakaiensis) 		no annotation 5 GLY A 158
SER A 166
LEU A 167
ALA A 170
ALA A 179
 None
 1.10A 4uckB-5xjhA:
undetectable		 4uckB-5xjhA:
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.
5z9s GLYCOSYL HYDROLASE
FAMILY 3 PROTEIN

(Bifidobacterium
longum) 		no annotation 5 GLY A 243
GLY A 276
ASN A 275
ALA A 196
ALA A 186
 None
 1.07A 4uckB-5z9sA:
undetectable		 4uckB-5z9sA:
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.
6ane POLY(ETHYLENE
TEREPHTHALATE)
HYDROLASE

(Ideonella
sakaiensis) 		no annotation 5 GLY A 131
SER A 139
LEU A 140
ALA A 143
ALA A 152
 None
 1.10A 4uckB-6aneA:
undetectable		 4uckB-6aneA:
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.
6b3r PIEZO-TYPE
MECHANOSENSITIVE ION
CHANNEL COMPONENT 1

(Mus musculus) 		no annotation 5 GLY A1549
LEU A1309
ASP A1308
THR A1196
ALA A1313
 None
 1.13A 4uckB-6b3rA:
undetectable		 4uckB-6b3rA:
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.
6em0 2-HYDROXYBIPHENYL-3-
MONOOXYGENASE

(Pseudomonas
nitroreducens) 		no annotation 5 GLY A  18
GLY A  13
LEU A  24
ALA A  26
ALA A 131
 None
FAD  A 601 (-2.8A)
None
None
None
 1.07A 4uckB-6em0A:
undetectable		 4uckB-6em0A:
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.
6erc PEROXINECTIN A

(Dictyostelium
discoideum) 		no annotation 5 GLY A 167
GLY A  29
ASN A  32
LEU A 105
THR A 139
 NA  A 609 (-3.8A)
None
None
HEM  A 604 ( 4.9A)
None
 1.08A 4uckB-6ercA:
undetectable		 4uckB-6ercA:
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.
6gbh HOPQ

(Helicobacter
pylori) 		no annotation 5 GLY C 136
ASN C 117
LEU C 150
ALA C 156
THR C 157
 None
 1.10A 4uckB-6gbhC:
undetectable		 4uckB-6gbhC:
undetectable