SIMILAR PATTERNS OF AMINO ACIDS FOR 3HCR_B_CHDB924

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.
1b63 MUTL

(Escherichia
coli) 		PF01119
(DNA_mis_repair)
PF13589
(HATPase_c_3) 		4 LEU A 110
ARG A  57
SER A  78
GLY A  60
 None
None
ANP  A 380 (-2.7A)
None
 1.06A 3hcrB-1b63A:
undetectable		 3hcrB-1b63A:
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.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 LEU A 390
ARG A 433
GLY A 519
MET A 522
 HEM  A 601 ( 4.7A)
None
None
None
 1.09A 3hcrB-1ebvA:
undetectable		 3hcrB-1ebvA:
22.61
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.
1jqo PHOSPHOENOLPYRUVATE
CARBOXYLASE

(Zea mays) 		PF00311
(PEPcase) 		4 LEU A 559
ARG A 293
SER A 449
GLY A 290
 None
 1.08A 3hcrB-1jqoA:
undetectable		 3hcrB-1jqoA:
17.51
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.
1k1x 4-ALPHA-GLUCANOTRANS
FERASE

(Thermococcus
litoralis) 		PF03065
(Glyco_hydro_57)
PF09094
(DUF1925)
PF09095
(DUF1926) 		4 ARG A 370
PRO A  53
SER A  51
GLY A  17
 None
 0.98A 3hcrB-1k1xA:
undetectable		 3hcrB-1k1xA:
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.
1l1l RIBONUCLEOSIDE
TRIPHOSPHATE
REDUCTASE

(Lactobacillus
leichmannii) 		PF02867
(Ribonuc_red_lgC) 		4 LEU A 250
PRO A 136
SER A 137
GLY A 226
 None
 1.06A 3hcrB-1l1lA:
undetectable		 3hcrB-1l1lA:
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.
1mw9 DNA TOPOISOMERASE I

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01751
(Toprim) 		4 LEU X 564
ARG X 169
GLY X 176
MET X 178
 None
 1.01A 3hcrB-1mw9X:
5.5		 3hcrB-1mw9X:
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.
1obh LEUCYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
PF13603
(tRNA-synt_1_2)
PF14795
(Leucyl-specific) 		5 LEU A 473
ARG A 426
ARG A 428
PRO A  97
GLY A  83
 None
SO4  A1505 (-4.1A)
SO4  A1505 (-3.4A)
None
None
 1.31A 3hcrB-1obhA:
undetectable		 3hcrB-1obhA:
18.17
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.
1p31 UDP-N-ACETYLMURAMATE
--ALANINE LIGASE

(Haemophilus
influenzae) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 LEU A 184
ARG A 118
GLY A  33
MET A  31
 None
None
None
EPU  A 598 (-4.5A)
 1.05A 3hcrB-1p31A:
2.1		 3hcrB-1p31A:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1su7 CARBON MONOXIDE
DEHYDROGENASE 2

(Carboxydothermus
hydrogenoformans) 		PF03063
(Prismane) 		4 LEU A 209
ARG A  80
PRO A 584
GLY A  45
 None
SF4  A 637 (-3.8A)
None
None
 0.93A 3hcrB-1su7A:
4.2		 3hcrB-1su7A:
19.90
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.
1taq TAQ DNA POLYMERASE

(Thermus
aquaticus) 		PF00476
(DNA_pol_A)
PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N)
PF09281
(Taq-exonuc) 		4 LEU A 367
ARG A 435
PRO A 301
GLY A 304
 None
 1.02A 3hcrB-1taqA:
4.0		 3hcrB-1taqA:
17.53
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.
1tnu GERANYLGERANYL
TRANSFERASE TYPE I
BETA SUBUNIT

(Rattus
norvegicus) 		PF00432
(Prenyltrans) 		4 LEU B  58
ARG B  27
ARG B  31
GLY B 308
 None
 0.95A 3hcrB-1tnuB:
undetectable		 3hcrB-1tnuB:
20.81
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.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 1

(Streptomyces
coelicolor) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 LEU A 383
ARG A 318
GLY A 282
MET A 285
 None
 1.02A 3hcrB-1tqyA:
2.2		 3hcrB-1tqyA:
23.16
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.
1w0m TRIOSEPHOSPHATE
ISOMERASE

(Thermoproteus
tenax) 		PF00121
(TIM)
PF05690
(ThiG) 		4 LEU A 194
ARG A 154
PRO A 142
GLY A 181
 None
None
None
PO4  A1226 (-3.6A)
 1.04A 3hcrB-1w0mA:
undetectable		 3hcrB-1w0mA:
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.
1w94 PROBABLE BRIX-DOMAIN
RIBOSOMAL BIOGENESIS
PROTEIN

(Methanothermobacter
thermautotrophicus) 		no annotation 4 LEU A   3
ARG A  14
GLY A  32
MET A  34
 None
 1.04A 3hcrB-1w94A:
undetectable		 3hcrB-1w94A:
18.21
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.
1wwl MONOCYTE
DIFFERENTIATION
ANTIGEN CD14

(Mus musculus) 		no annotation 4 LEU A  40
PRO A 123
SER A  97
GLY A  89
 None
 1.07A 3hcrB-1wwlA:
undetectable		 3hcrB-1wwlA:
22.82
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.
1ywg GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Plasmodium
falciparum) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 LEU O 103
PRO O  82
SER O 110
GLY O  10
 None
None
None
NAD  O 401 (-3.5A)
 0.98A 3hcrB-1ywgO:
2.5		 3hcrB-1ywgO:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c2n MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Homo sapiens) 		PF00698
(Acyl_transf_1) 		4 LEU A 339
PRO A  32
SER A  92
GLY A  35
 None
AE4  A1346 (-4.2A)
None
None
 1.05A 3hcrB-2c2nA:
undetectable		 3hcrB-2c2nA:
21.03
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.
2ci6 NG,
NG-DIMETHYLARGININE
DIMETHYLAMINOHYDROLA
SE 1

(Bos taurus) 		PF02274
(Amidinotransf) 		4 LEU A  59
ARG A  11
GLY A 230
MET A 255
 None
 1.05A 3hcrB-2ci6A:
undetectable		 3hcrB-2ci6A:
22.45
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.
2dj1 PROTEIN
DISULFIDE-ISOMERASE
A4

(Mus musculus) 		PF00085
(Thioredoxin) 		4 LEU A  83
PRO A 137
SER A 135
GLY A 101
 None
 0.99A 3hcrB-2dj1A:
3.2		 3hcrB-2dj1A:
16.81
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.
2g17 N-ACETYL-GAMMA-GLUTA
MYL-PHOSPHATE
REDUCTASE

(Salmonella
enterica) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		4 LEU A 280
ARG A 237
SER A 162
GLY A 312
 None
 1.02A 3hcrB-2g17A:
undetectable		 3hcrB-2g17A:
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.
2gtl EXTRACELLULAR
HEMOGLOBIN LINKER L3
SUBUNIT

(Lumbricus
terrestris) 		PF00057
(Ldl_recept_a)
PF16915
(Eryth_link_C) 		4 LEU O 176
ARG O 199
GLY O 110
MET O 125
 None
 1.09A 3hcrB-2gtlO:
undetectable		 3hcrB-2gtlO:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ija ARYLAMINE
N-ACETYLTRANSFERASE
1

(Homo sapiens) 		PF00797
(Acetyltransf_2) 		4 LEU A  69
ARG A 197
SER A 215
GLY A 104
 ACM  A 301 ( 4.8A)
None
None
None
 0.98A 3hcrB-2ijaA:
undetectable		 3hcrB-2ijaA:
21.50
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.
2ljr GLUTATHIONE
S-TRANSFERASE

(Homo sapiens) 		PF00043
(GST_C)
PF02798
(GST_N) 		4 ARG A 239
PRO A  13
SER A  67
GLY A 108
 None
 1.05A 3hcrB-2ljrA:
undetectable		 3hcrB-2ljrA:
23.51
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.
2myi EXODEOXYRIBONUCLEASE
III

(Pseudomonas sp.
Lz4W) 		PF03372
(Exo_endo_phos) 		4 ARG A  37
PRO A 110
SER A 148
GLY A  66
 None
 0.98A 3hcrB-2myiA:
undetectable		 3hcrB-2myiA:
22.99
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.
2o78 PUTATIVE HISTIDINE
AMMONIA-LYASE

(Rhodobacter
sphaeroides) 		PF00221
(Lyase_aromatic) 		4 LEU A 233
ARG A 273
ARG A 238
GLY A 388
 None
 1.06A 3hcrB-2o78A:
undetectable		 3hcrB-2o78A:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o78 PUTATIVE HISTIDINE
AMMONIA-LYASE

(Rhodobacter
sphaeroides) 		PF00221
(Lyase_aromatic) 		4 LEU A 467
ARG A 379
SER A 483
GLY A 239
 None
 1.06A 3hcrB-2o78A:
undetectable		 3hcrB-2o78A:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ozv HYPOTHETICAL PROTEIN
ATU0636

(Agrobacterium
fabrum) 		PF05175
(MTS) 		4 LEU A 119
ARG A  76
GLY A  52
MET A 129
 None
 0.94A 3hcrB-2ozvA:
undetectable		 3hcrB-2ozvA:
21.13
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.
2pfr ARYLAMINE
N-ACETYLTRANSFERASE
2

(Homo sapiens) 		PF00797
(Acetyltransf_2) 		4 LEU A  69
ARG A 197
SER A 215
GLY A 104
 None
None
COA  A 401 (-4.0A)
COA  A 401 (-4.0A)
 0.99A 3hcrB-2pfrA:
undetectable		 3hcrB-2pfrA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q1f CHONDROITINASE

(Bacteroides
thetaiotaomicron) 		PF02278
(Lyase_8)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		4 LEU A 640
ARG A 514
PRO A 658
GLY A 520
 None
 0.99A 3hcrB-2q1fA:
undetectable		 3hcrB-2q1fA:
17.74
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.
2x40 BETA-GLUCOSIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 LEU A 116
PRO A  26
SER A  34
GLY A  22
 GOL  A1726 ( 4.8A)
None
None
None
 1.00A 3hcrB-2x40A:
2.5		 3hcrB-2x40A:
19.05
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.
2y7c TYPE-1 RESTRICTION
ENZYME ECOKI
SPECIFICITY PROTEIN

(Escherichia
coli) 		PF01420
(Methylase_S) 		4 LEU A 444
ARG A 451
SER A 412
GLY A 420
 None
 1.03A 3hcrB-2y7cA:
undetectable		 3hcrB-2y7cA:
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.
2ywi HYPOTHETICAL
CONSERVED PROTEIN

(Geobacillus
kaustophilus) 		PF00578
(AhpC-TSA) 		4 LEU A  66
PRO A 152
SER A 150
GLY A 185
 None
 1.05A 3hcrB-2ywiA:
undetectable		 3hcrB-2ywiA:
18.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3aqi FERROCHELATASE

(Homo sapiens) 		PF00762
(Ferrochelatase) 		6 LEU A 101
ARG A 114
PRO A 266
SER A 268
GLY A 306
MET A 308
 CHD  A   3 ( 4.9A)
CHD  A   2 (-3.6A)
CHD  A   2 ( 4.5A)
CHD  A   2 ( 4.4A)
CHD  A   2 ( 3.8A)
None
 0.83A 3hcrB-3aqiA:
53.6		 3hcrB-3aqiA:
99.44
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.
3cj1 ECTONUCLEOSIDE
TRIPHOSPHATE
DIPHOSPHOHYDROLASE 2

(Rattus
norvegicus) 		PF01150
(GDA1_CD39) 		4 LEU A 140
ARG A 126
SER A  95
GLY A  47
 None
 1.04A 3hcrB-3cj1A:
2.4		 3hcrB-3cj1A:
21.34
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.
3cwc PUTATIVE GLYCERATE
KINASE 2

(Salmonella
enterica) 		PF02595
(Gly_kinase) 		4 LEU A 198
ARG A 228
SER A 136
GLY A 165
 None
 1.05A 3hcrB-3cwcA:
5.3		 3hcrB-3cwcA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e3x BIPA

(Vibrio
parahaemolyticus) 		PF00679
(EFG_C) 		4 LEU A  90
ARG A  70
PRO A 123
SER A 169
 None
None
None
EDO  A1001 ( 4.5A)
 1.00A 3hcrB-3e3xA:
undetectable		 3hcrB-3e3xA:
23.08
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.
3eu8 PUTATIVE
GLUCOAMYLASE

(Bacteroides
fragilis) 		PF10091
(Glycoamylase)
PF11329
(DUF3131) 		4 LEU A  96
ARG A 106
SER A 434
GLY A 173
 None
EDO  A 458 ( 3.9A)
None
None
 1.06A 3hcrB-3eu8A:
undetectable		 3hcrB-3eu8A:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hwc CHLOROPHENOL-4-MONOO
XYGENASE COMPONENT 2

(Burkholderia
cepacia) 		PF03241
(HpaB)
PF11794
(HpaB_N) 		4 ARG A3068
PRO A3357
SER A3343
GLY A3078
 None
 0.98A 3hcrB-3hwcA:
undetectable		 3hcrB-3hwcA:
23.54
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.
3i6e MUCONATE
CYCLOISOMERASE I

(Ruegeria
pomeroyi) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 LEU A 359
ARG A  89
GLY A 279
MET A 275
 None
 1.08A 3hcrB-3i6eA:
2.2		 3hcrB-3i6eA:
23.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k5z FEM-3 MRNA-BINDING
FACTOR 2

(Caenorhabditis
elegans) 		PF00806
(PUF) 		4 LEU A 207
PRO A 169
SER A 172
GLY A 192
 None
 1.04A 3hcrB-3k5zA:
undetectable		 3hcrB-3k5zA:
23.13
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.
3ll9 ISOPENTENYL
PHOSPHATE KINASE

(Methanothermobacter
thermautotrophicus) 		PF00696
(AA_kinase) 		4 ARG A 261
PRO A  38
SER A  39
GLY A 254
 None
 1.08A 3hcrB-3ll9A:
4.0		 3hcrB-3ll9A:
24.52
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.
3m6x RRNA METHYLASE

(Thermus
thermophilus) 		PF01189
(Methyltr_RsmB-F)
PF17125
(Methyltr_RsmF_N)
PF17126
(RsmF_methylt_CI) 		4 LEU A 106
PRO A 307
SER A 305
GLY A 351
 None
 1.00A 3hcrB-3m6xA:
2.1		 3hcrB-3m6xA:
23.58
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.
3nzp ARGININE
DECARBOXYLASE

(Campylobacter
jejuni) 		PF02784
(Orn_Arg_deC_N) 		4 LEU A  49
ARG A  39
SER A 449
GLY A  45
 None
 0.96A 3hcrB-3nzpA:
undetectable		 3hcrB-3nzpA:
21.77
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.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 LEU A  53
PRO A 245
SER A 289
GLY A  40
 None
 0.97A 3hcrB-3ogrA:
undetectable		 3hcrB-3ogrA:
16.70
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.
3rh9 SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE
(NAD(P)(+))

(Marinobacter
hydrocarbonoclasticus) 		PF00171
(Aldedh) 		4 LEU A 166
ARG A  71
GLY A 147
MET A 227
 None
 1.07A 3hcrB-3rh9A:
2.2		 3hcrB-3rh9A:
18.74
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.
3s6k ACETYLGLUTAMATE
KINASE

(Xanthomonas
campestris) 		PF00696
(AA_kinase)
PF04768
(NAT) 		4 LEU A 362
ARG A 385
SER A 318
GLY A 377
 None
 0.92A 3hcrB-3s6kA:
3.4		 3hcrB-3s6kA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sbq NITROUS-OXIDE
REDUCTASE

(Pseudomonas
stutzeri) 		no annotation 4 LEU A 355
ARG A 367
SER A 331
GLY A 372
 None
 1.08A 3hcrB-3sbqA:
undetectable		 3hcrB-3sbqA:
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.
3t9p MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Roseovarius sp.
TM1035) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 LEU A 127
PRO A 279
GLY A 285
MET A 282
 None
 0.94A 3hcrB-3t9pA:
undetectable		 3hcrB-3t9pA:
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.
3tvi ASPARTOKINASE

(Clostridium
acetobutylicum) 		PF00696
(AA_kinase)
PF01842
(ACT) 		4 LEU A  54
ARG A  77
SER A 187
GLY A  41
 None
None
ASP  A 451 (-2.2A)
None
 1.05A 3hcrB-3tviA:
2.3		 3hcrB-3tviA:
21.93
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.
3voc BETA/ALPHA-AMYLASE

(Paenibacillus
polymyxa) 		PF01373
(Glyco_hydro_14) 		4 LEU A 308
ARG A 165
PRO A 124
GLY A 159
 None
 0.86A 3hcrB-3vocA:
undetectable		 3hcrB-3vocA:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ay2 PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX58

(Homo sapiens) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		4 LEU A 614
ARG A 559
PRO A 658
GLY A 649
 None
 1.08A 3hcrB-4ay2A:
3.9		 3hcrB-4ay2A:
19.36
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.
4ccw CARBOXYL ESTERASE NP

(Bacillus
subtilis) 		PF12697
(Abhydrolase_6) 		5 LEU A 131
ARG A 105
PRO A  98
SER A 211
GLY A 103
 None
 1.32A 3hcrB-4ccwA:
2.7		 3hcrB-4ccwA:
21.24
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.
4e0f RIBOFLAVIN SYNTHASE
SUBUNIT ALPHA

(Brucella
abortus) 		PF00677
(Lum_binding) 		4 LEU A 127
ARG A 116
SER A  44
GLY A 175
 None
 1.04A 3hcrB-4e0fA:
undetectable		 3hcrB-4e0fA:
20.89
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.
4eut SERINE/THREONINE-PRO
TEIN KINASE TBK1

(Homo sapiens) 		PF00069
(Pkinase) 		4 LEU A 277
PRO A 220
SER A 247
GLY A 217
 None
 1.01A 3hcrB-4eutA:
undetectable		 3hcrB-4eutA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f1n KPAGO

(Vanderwaltozyma
polyspora) 		PF02171
(Piwi) 		4 LEU A1237
ARG A1203
SER A1020
GLY A1002
 None
U  E   1 ( 4.5A)
None
None
 1.03A 3hcrB-4f1nA:
undetectable		 3hcrB-4f1nA:
16.14
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.
4f32 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Burkholderia
vietnamiensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 LEU A  27
PRO A 231
SER A 229
GLY A 391
 None
 1.03A 3hcrB-4f32A:
undetectable		 3hcrB-4f32A:
21.14
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.
4f4w DNA POLYMERASE IV

(Sulfolobus
acidocaldarius;
Sulfolobus
solfataricus) 		PF00817
(IMS)
PF11798
(IMS_HHH) 		4 ARG A 280
ARG A 243
SER A 298
GLY A 247
 None
 0.93A 3hcrB-4f4wA:
undetectable		 3hcrB-4f4wA:
20.94
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.
4fno PEPTIDYL-TRNA
HYDROLASE

(Pseudomonas
aeruginosa) 		PF01195
(Pept_tRNA_hydro) 		4 LEU A  40
ARG A  31
SER A  75
GLY A  25
 None
 1.06A 3hcrB-4fnoA:
4.1		 3hcrB-4fnoA:
20.72
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.
4gox POLYKETIDE SYNTHASE

(Synechococcus
sp. PCC 7002) 		PF13469
(Sulfotransfer_3) 		4 LEU A 159
ARG A  46
SER A 169
GLY A 265
 None
None
A3P  A 401 (-2.6A)
None
 1.03A 3hcrB-4goxA:
2.3		 3hcrB-4goxA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hbz PUTATIVE
PHOSPHOHISTIDINE
PHOSPHATASE, SIXA

(Nakamurella
multipartita) 		PF00300
(His_Phos_1) 		4 LEU A  38
ARG A  72
GLY A 116
MET A  22
 None
 1.01A 3hcrB-4hbzA:
undetectable		 3hcrB-4hbzA:
20.39
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.
4jga 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Rickettsia
rickettsii) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 LEU A 408
ARG A 299
SER A 178
GLY A 293
 None
 1.09A 3hcrB-4jgaA:
2.2		 3hcrB-4jgaA:
19.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jn7 ENOLASE

(Agrobacterium
tumefaciens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 LEU A  48
PRO A  78
SER A  74
GLY A 270
 None
 0.84A 3hcrB-4jn7A:
2.3		 3hcrB-4jn7A:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m18 PULMONARY
SURFACTANT-ASSOCIATE
D PROTEIN D

(Homo sapiens) 		PF00059
(Lectin_C)
PF09006
(Surfac_D-trimer) 		4 LEU A 268
ARG A 349
SER A 298
GLY A 346
 None
MAN  A 407 (-3.9A)
None
None
 1.05A 3hcrB-4m18A:
undetectable		 3hcrB-4m18A:
18.36
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.
4myd 2-SUCCINYL-6-HYDROXY
-2,4-CYCLOHEXADIENE-
1-CARBOXYLATE
SYNTHASE

(Escherichia
coli) 		PF12697
(Abhydrolase_6) 		4 LEU A  72
PRO A  48
SER A  53
GLY A  88
 None
 1.00A 3hcrB-4mydA:
3.6		 3hcrB-4mydA:
20.64
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.
4of8 IRREGULAR CHIASM
C-ROUGHEST PROTEIN

(Drosophila
melanogaster) 		PF07679
(I-set)
PF08205
(C2-set_2) 		4 LEU A  67
PRO A  34
SER A 121
GLY A 125
 None
None
None
GOL  A 302 (-3.6A)
 0.90A 3hcrB-4of8A:
undetectable		 3hcrB-4of8A:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ptf DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 LEU A 978
PRO A 433
SER A 436
GLY A 983
 None
 0.90A 3hcrB-4ptfA:
undetectable		 3hcrB-4ptfA:
14.70
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.
4qt9 PUTATIVE
GLUCOAMYLASE

(Bacteroides
caccae) 		PF10091
(Glycoamylase) 		4 LEU A 106
ARG A 116
SER A 444
GLY A 183
 None
 1.08A 3hcrB-4qt9A:
undetectable		 3hcrB-4qt9A:
23.40
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.
4rul DNA TOPOISOMERASE 1

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01396
(zf-C4_Topoisom)
PF01751
(Toprim)
PF08272
(Topo_Zn_Ribbon) 		4 LEU A 564
ARG A 169
GLY A 176
MET A 178
 None
SO4  A1005 (-2.7A)
None
None
 1.05A 3hcrB-4rulA:
2.7		 3hcrB-4rulA:
18.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xea PEPTIDASE M16 DOMAIN
PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		4 LEU A 334
ARG A 258
SER A 293
GLY A 308
 None
 1.08A 3hcrB-4xeaA:
undetectable		 3hcrB-4xeaA:
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.
4xwt DR2417

(Deinococcus
radiodurans) 		PF00753
(Lactamase_B)
PF07521
(RMMBL) 		4 LEU A 387
ARG A 215
SER A 190
GLY A 380
 None
None
None
U5P  A 606 (-3.4A)
 0.99A 3hcrB-4xwtA:
3.5		 3hcrB-4xwtA:
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.
5b7z UNCHARACTERIZED
PROTEIN TM_0416

(Thermotoga
maritima) 		PF01261
(AP_endonuc_2) 		4 LEU A 137
ARG A 115
PRO A  45
GLY A  68
 None
None
MPD  A 302 ( 4.8A)
None
 1.06A 3hcrB-5b7zA:
undetectable		 3hcrB-5b7zA:
23.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
NON-CATALYTIC
SUBUNIT TRM6

(Homo sapiens) 		PF04189
(Gcd10p) 		4 LEU B 384
SER B 426
GLY B 195
MET B 191
 None
 1.08A 3hcrB-5ccxB:
2.4		 3hcrB-5ccxB:
23.08
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.
5fv4 CARBOXYLIC ESTER
HYDROLASE

(Sus scrofa) 		PF00135
(COesterase) 		4 LEU A 341
PRO A 410
SER A 411
GLY A 237
 None
 1.09A 3hcrB-5fv4A:
3.3		 3hcrB-5fv4A:
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.
5gkk PUTATIVE HOMING
ENDONUCLEASE

(Thermotoga
neapolitana) 		PF00961
(LAGLIDADG_1) 		4 LEU A  80
ARG A  73
ARG A  39
GLY A  21
 None
 0.95A 3hcrB-5gkkA:
undetectable		 3hcrB-5gkkA:
16.94
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.
5gr8 LEUCINE-RICH REPEAT
RECEPTOR-LIKE
PROTEIN KINASE PEPR1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		4 LEU A 272
PRO A 308
SER A 310
GLY A 282
 None
None
NAG  A 805 ( 4.8A)
SO4  A 807 (-3.9A)
 1.08A 3hcrB-5gr8A:
undetectable		 3hcrB-5gr8A:
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.
5gw7 GLUCOSIDASE YGJK

(Escherichia
coli) 		PF01204
(Trehalase) 		4 LEU A  42
PRO A 740
SER A 309
GLY A 723
 None
 0.94A 3hcrB-5gw7A:
undetectable		 3hcrB-5gw7A:
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.
5i2x ADRENOCORTICAL
DYSPLASIA PROTEIN
HOMOLOG

(Homo sapiens) 		PF10341
(TPP1) 		4 LEU A 183
ARG A 154
SER A 165
GLY A 141
 None
 1.08A 3hcrB-5i2xA:
undetectable		 3hcrB-5i2xA:
15.89
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.
5i5l BACTERIOPHYTOCHROME
PROTEIN

(Agrobacterium
fabrum) 		PF00360
(PHY)
PF01590
(GAF)
PF08446
(PAS_2) 		4 ARG A 244
PRO A 215
SER A 286
MET A 263
 BLA  A 601 (-3.0A)
None
None
None
 1.05A 3hcrB-5i5lA:
undetectable		 3hcrB-5i5lA:
22.40
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.
5j7x DIMETHYLANILINE
MONOOXYGENASE,
PUTATIVE

(Aspergillus
flavus) 		PF00743
(FMO-like) 		4 LEU A 402
PRO A 435
SER A 437
GLY A  19
 None
None
None
FAD  A 601 (-3.3A)
 1.08A 3hcrB-5j7xA:
undetectable		 3hcrB-5j7xA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m59 PRE-MRNA SPLICING
HELICASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		4 ARG A1248
SER A1543
GLY A1512
MET A1510
 None
 0.88A 3hcrB-5m59A:
3.6		 3hcrB-5m59A:
11.85
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.
5n8o DNA HELICASE I

(Escherichia
coli) 		PF07057
(TraI)
PF08751
(TrwC)
PF13604
(AAA_30) 		4 ARG A1276
PRO A  87
SER A  89
GLY A 222
 None
 0.99A 3hcrB-5n8oA:
undetectable		 3hcrB-5n8oA:
11.67
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.
5oji DEHYDROGENASE/REDUCT
ASE SDR FAMILY
MEMBER 4

(Caenorhabditis
elegans) 		no annotation 4 ARG A 223
PRO A 191
SER A 148
GLY A 254
 None
NAP  A 301 (-3.9A)
ISN  A 302 ( 2.2A)
None
 1.09A 3hcrB-5ojiA:
3.6		 3hcrB-5ojiA:
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.
5okz EXOSOME COMPLEX
COMPONENT MTR3

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH) 		4 LEU F  48
ARG F 236
GLY F 192
MET F 190
 None
 1.07A 3hcrB-5okzF:
undetectable		 3hcrB-5okzF:
23.08
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.
5the UNCHARACTERIZED
PROTEIN

(Vanderwaltozyma
polyspora) 		no annotation 4 LEU A1237
ARG A1203
SER A1020
GLY A1002
 None
U  B   1 ( 4.0A)
None
None
 0.92A 3hcrB-5theA:
5.5		 3hcrB-5theA:
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.
5thx FERREDOXIN--NADP
REDUCTASE

(Neisseria
gonorrhoeae) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 LEU A 225
ARG A 190
PRO A 121
SER A  54
GLY A 116
 None
NAP  A 301 (-3.3A)
None
FAD  A 303 (-3.8A)
NAP  A 301 ( 3.9A)
 1.45A 3hcrB-5thxA:
2.5		 3hcrB-5thxA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5txf PHOSPHATIDYLCHOLINE-
STEROL
ACYLTRANSFERASE

(Homo sapiens) 		no annotation 4 LEU A 301
ARG A 193
SER A 249
GLY A 151
 None
 0.93A 3hcrB-5txfA:
3.2		 3hcrB-5txfA:
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.
5v57 SMOOTHENED
HOMOLOG,FLAVODOXIN,S
MOOTHENED HOMOLOG

(Desulfovibrio
vulgaris;
Homo sapiens) 		PF00258
(Flavodoxin_1)
PF01392
(Fz)
PF01534
(Frizzled) 		4 LEU A 125
ARG A 168
ARG A 173
GLY A  94
 None
 0.81A 3hcrB-5v57A:
5.1		 3hcrB-5v57A:
19.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 4 LEU A 410
ARG A 400
SER A 380
GLY A 394
 None
None
C2F  A3001 (-4.7A)
None
 0.92A 3hcrB-5vopA:
3.5		 3hcrB-5vopA:
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.
5w99 PBTD

(Planobispora
rosea) 		no annotation 4 LEU A 266
ARG A 180
SER A 279
GLY A 175
 A1V  A 401 (-4.3A)
None
None
A1V  A 401 ( 4.8A)
 1.08A 3hcrB-5w99A:
undetectable		 3hcrB-5w99A:
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.
5whr INDOLEAMINE
2,3-DIOXYGENASE 1

(Homo sapiens) 		no annotation 4 LEU A  70
ARG A  77
ARG A  80
GLY A  84
 None
 1.08A 3hcrB-5whrA:
undetectable		 3hcrB-5whrA:
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.
5ww1 PULULLANASE

(Paenibacillus
barengoltzii) 		no annotation 4 LEU A 599
SER A 485
GLY A 460
MET A 434
 None
 1.00A 3hcrB-5ww1A:
undetectable		 3hcrB-5ww1A:
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.
5x6o SERINE/THREONINE-PRO
TEIN KINASE MEC1

(Saccharomyces
cerevisiae) 		no annotation 4 LEU C2264
ARG C2225
SER C2285
GLY C2217
 None
 1.08A 3hcrB-5x6oC:
undetectable		 3hcrB-5x6oC:
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) 		4 LEU A 646
PRO A 544
SER A 545
GLY A 493
 None
EDO  A1804 (-4.8A)
EDO  A1804 (-3.8A)
None
 1.07A 3hcrB-5x7sA:
undetectable		 3hcrB-5x7sA:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yvs ALCOHOL
DEHYDROGENASE

(candidate
divison MSBL1
archaeon
SCGC-AAA259E19) 		no annotation 4 LEU A 349
ARG A 239
GLY A 244
MET A 193
 None
 1.09A 3hcrB-5yvsA:
2.7		 3hcrB-5yvsA:
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 4 LEU A 170
ARG A 731
PRO A 596
GLY A 618
 None
 0.89A 3hcrB-5z9sA:
2.3		 3hcrB-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.
6apj ALPHA-N-ACETYLGALACT
OSAMINIDE
ALPHA-2,6-SIALYLTRAN
SFERASE 2

(Homo sapiens) 		no annotation 4 LEU A 371
ARG A 374
SER A 304
GLY A 157
 None
 1.07A 3hcrB-6apjA:
undetectable		 3hcrB-6apjA:
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.
6azi D-ALANYL-D-ALANINE
ENDOPEPTIDASE

(Enterobacter
cloacae) 		PF00768
(Peptidase_S11) 		4 LEU A 179
ARG A  64
SER A 125
GLY A 240
 None
None
SEE  A  68 ( 1.4A)
None
 1.04A 3hcrB-6aziA:
undetectable		 3hcrB-6aziA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6azp MYELOPEROXIDASE
STAPHYLOCOCCAL
PEROXIDASE INHIBITOR

(Homo sapiens;
Staphylococcus
aureus) 		no annotation
no annotation 		4 LEU B  49
ARG A 351
SER A 406
GLY A 344
 None
 1.04A 3hcrB-6azpB:
undetectable		 3hcrB-6azpB:
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.
6bnp UNCONVENTIONAL
MYOSIN-VI

(Sus scrofa) 		no annotation 4 LEU I 306
PRO I 268
SER I 297
GLY I 277
 None
 1.00A 3hcrB-6bnpI:
undetectable		 3hcrB-6bnpI:
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.
6fsw RIBOSOME MATURATION
PROTEIN SDO1-LIKE
PROTEIN

(Archaeoglobus
fulgidus) 		no annotation 4 PRO A 121
SER A 110
GLY A 213
MET A 211
 None
 1.04A 3hcrB-6fswA:
undetectable		 3hcrB-6fswA:
undetectable