SIMILAR PATTERNS OF AMINO ACIDS FOR 5N0X_B_SAMB501_1

List of similar pattern of amino acids derived from ASSAM search

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

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

(Streptococcus
dysgalactiae) 		PF02821
(Staphylokinase) 		3 SER C 105
ALA C 104
THR C  25
 None
 0.63A 5n0xB-1bmlC:
0.0		 5n0xB-1bmlC:
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.
1byr PROTEIN
(ENDONUCLEASE)

(Salmonella
enterica) 		PF13091
(PLDc_2) 		3 SER A  21
ALA A  22
THR A 104
 None
 0.72A 5n0xB-1byrA:
undetectable		 5n0xB-1byrA:
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.
1eq2 ADP-L-GLYCERO-D-MANN
OHEPTOSE 6-EPIMERASE

(Escherichia
coli) 		PF01370
(Epimerase) 		3 SER A 116
ALA A 117
THR A 276
 NAP  A2400 (-3.1A)
None
None
 0.51A 5n0xB-1eq2A:
0.0		 5n0xB-1eq2A:
22.20
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.
1jhk IG GAMMA-1-CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 SER H  25
ALA H  24
THR H  94
 None
 0.74A 5n0xB-1jhkH:
0.0		 5n0xB-1jhkH:
18.05
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.
1kv9 TYPE II
QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Pseudomonas
putida) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		3 SER A 485
ALA A 486
THR A 392
 None
 0.75A 5n0xB-1kv9A:
0.0		 5n0xB-1kv9A:
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.
1kxq ANTIBODY VHH
FRAGMENT CABAMD9

(Camelus
dromedarius) 		PF07686
(V-set) 		3 SER E  25
ALA E  24
THR E  95
 None
 0.73A 5n0xB-1kxqE:
undetectable		 5n0xB-1kxqE:
14.11
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.
1l4d STREPTOKINASE

(Streptococcus
dysgalactiae) 		PF02821
(Staphylokinase) 		3 SER B 105
ALA B 104
THR B  25
 None
 0.54A 5n0xB-1l4dB:
undetectable		 5n0xB-1l4dB:
14.95
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.
1l4z STREPTOKINASE

(Streptococcus
dysgalactiae) 		PF02821
(Staphylokinase) 		3 SER B 105
ALA B 104
THR B  25
 None
 0.67A 5n0xB-1l4zB:
undetectable		 5n0xB-1l4zB:
15.72
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.
1n8p CYSTATHIONINE
GAMMA-LYASE

(Saccharomyces
cerevisiae) 		PF01053
(Cys_Met_Meta_PP) 		3 SER A 200
ALA A 201
THR A 246
 PLP  A 400 (-2.7A)
None
None
 0.63A 5n0xB-1n8pA:
1.8		 5n0xB-1n8pA:
23.88
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.
1nfd H57 FAB

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 SER E  90
ALA E  33
THR E  66
 None
 0.71A 5n0xB-1nfdE:
undetectable		 5n0xB-1nfdE:
19.32
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.
1npc NEUTRAL PROTEASE

(Bacillus cereus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		3 SER A 135
ALA A  74
THR A  42
 None
 0.75A 5n0xB-1npcA:
undetectable		 5n0xB-1npcA:
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.
1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE

(Thermus
thermophilus) 		PF01467
(CTP_transf_like) 		3 SER A  47
ALA A  48
THR A  69
 None
 0.73A 5n0xB-1od6A:
undetectable		 5n0xB-1od6A:
17.13
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.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 1

(Streptomyces
coelicolor) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		3 SER A 251
ALA A 252
THR A   8
 None
 0.75A 5n0xB-1tqyA:
undetectable		 5n0xB-1tqyA:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vko INOSITOL-3-PHOSPHATE
SYNTHASE

(Caenorhabditis
elegans) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		3 SER A 277
ALA A 274
THR A 292
 None
 0.71A 5n0xB-1vkoA:
1.9		 5n0xB-1vkoA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w36 EXODEOXYRIBONUCLEASE
V GAMMA CHAIN

(Escherichia
coli) 		PF04257
(Exonuc_V_gamma) 		3 SER C  84
ALA C  85
THR C 176
 None
 0.36A 5n0xB-1w36C:
0.9		 5n0xB-1w36C:
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.
1wlg FLAGELLAR HOOK
PROTEIN FLGE

(Salmonella
enterica) 		PF07559
(FlaE) 		3 SER A 152
ALA A 151
THR A 148
 None
 0.73A 5n0xB-1wlgA:
undetectable		 5n0xB-1wlgA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xp4 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Streptococcus
pneumoniae) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		3 SER A  97
ALA A  96
THR A 166
 SO4  A 464 ( 3.9A)
None
None
 0.47A 5n0xB-1xp4A:
undetectable		 5n0xB-1xp4A:
24.00
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.
1z2i MALATE DEHYDROGENASE

(Agrobacterium
tumefaciens) 		PF02615
(Ldh_2) 		3 SER A 248
ALA A 276
THR A  99
 None
 0.71A 5n0xB-1z2iA:
undetectable		 5n0xB-1z2iA:
21.68
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.
2clb DPS-LIKE PROTEIN

(Sulfolobus
solfataricus) 		PF00210
(Ferritin) 		3 SER A  99
ALA A 100
THR A 130
 None
 0.71A 5n0xB-2clbA:
undetectable		 5n0xB-2clbA:
19.22
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.
2i6u ORNITHINE
CARBAMOYLTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		3 SER A 283
ALA A 284
THR A 138
 None
 0.73A 5n0xB-2i6uA:
2.0		 5n0xB-2i6uA:
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.
2m6k FERRIENTEROBACTIN-BI
NDING PERIPLASMIC
PROTEIN

(Escherichia
coli) 		PF01497
(Peripla_BP_2) 		3 SER A 210
ALA A 211
THR A  52
 None
 0.74A 5n0xB-2m6kA:
undetectable		 5n0xB-2m6kA:
22.43
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.
2p5i BH3822 PROTEIN

(Bacillus
halodurans) 		PF03099
(BPL_LplA_LipB) 		3 SER A  32
ALA A  29
THR A  60
 None
 0.70A 5n0xB-2p5iA:
undetectable		 5n0xB-2p5iA:
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.
2pfv EXOCYST COMPLEX
COMPONENT EXO70

(Saccharomyces
cerevisiae) 		PF03081
(Exo70) 		3 SER A  73
ALA A  72
THR A  67
 None
 0.57A 5n0xB-2pfvA:
undetectable		 5n0xB-2pfvA:
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.
2qny 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Mycobacterium
tuberculosis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		3 SER A  50
ALA A  51
THR A  80
 None
 0.71A 5n0xB-2qnyA:
undetectable		 5n0xB-2qnyA:
24.34
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.
2qzp ACYLAMINO-ACID-RELEA
SING ENZYME

(Aeropyrum
pernix) 		PF00326
(Peptidase_S9) 		3 SER A 433
ALA A 430
THR A 362
 None
 0.71A 5n0xB-2qzpA:
2.2		 5n0xB-2qzpA:
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.
2rui LPXTG-SITE
TRANSPEPTIDASE
FAMILY PROTEIN

(Bacillus
anthracis) 		PF04203
(Sortase) 		3 SER A 140
ALA A 139
THR A 186
 None
 0.75A 5n0xB-2ruiA:
undetectable		 5n0xB-2ruiA:
17.48
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.
2v5d O-GLCNACASE NAGJ

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C)
PF02838
(Glyco_hydro_20b)
PF07555
(NAGidase) 		3 SER A 303
ALA A 304
THR A 356
 None
 0.57A 5n0xB-2v5dA:
undetectable		 5n0xB-2v5dA:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x86 ADP-L-GLYCERO-D-MANN
O-HEPTOSE-6-EPIMERAS
E

(Escherichia
coli) 		PF01370
(Epimerase) 		3 SER A 116
ALA A 117
THR A 276
 BMA  A 402 ( 3.2A)
None
None
 0.31A 5n0xB-2x86A:
undetectable		 5n0xB-2x86A:
20.83
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.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE
IRON-SULFUR
ATP-BINDING PROTEIN

(Prochlorococcus
marinus) 		PF00142
(Fer4_NifH) 		3 SER A  54
ALA A  51
THR A 247
 None
 0.72A 5n0xB-2ynmA:
undetectable		 5n0xB-2ynmA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z61 PROBABLE ASPARTATE
AMINOTRANSFERASE 2

(Methanocaldococcus
jannaschii) 		PF00155
(Aminotran_1_2) 		3 SER A 203
ALA A 204
THR A 214
 None
 0.57A 5n0xB-2z61A:
undetectable		 5n0xB-2z61A:
21.11
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.
3a69 FLAGELLAR HOOK
PROTEIN FLGE

(Salmonella
enterica) 		PF00460
(Flg_bb_rod)
PF06429
(Flg_bbr_C)
PF07559
(FlaE) 		3 SER A 152
ALA A 151
THR A 148
 None
 0.73A 5n0xB-3a69A:
undetectable		 5n0xB-3a69A:
22.15
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.
3bhi CARBONYL REDUCTASE
[NADPH] 1

(Homo sapiens) 		PF00106
(adh_short) 		3 SER A 191
ALA A 192
THR A 109
 None
 0.63A 5n0xB-3bhiA:
undetectable		 5n0xB-3bhiA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bjc CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE

(Homo sapiens) 		PF00233
(PDEase_I) 		3 SER A 550
ALA A 551
THR A 557
 None
 0.74A 5n0xB-3bjcA:
undetectable		 5n0xB-3bjcA:
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.
3dr2 EXPORTED
GLUCONOLACTONASE

(Xanthomonas
campestris) 		PF08450
(SGL) 		3 SER A 280
ALA A 279
THR A 275
 None
 0.67A 5n0xB-3dr2A:
undetectable		 5n0xB-3dr2A:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ebl GIBBERELLIN RECEPTOR
GID1

(Oryza sativa) 		PF07859
(Abhydrolase_3) 		3 SER A 293
ALA A 324
THR A 334
 None
 0.76A 5n0xB-3eblA:
1.1		 5n0xB-3eblA:
21.16
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.
3egw RESPIRATORY NITRATE
REDUCTASE 1 ALPHA
CHAIN

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF14710
(Nitr_red_alph_N) 		3 SER A 240
ALA A 241
THR A  80
 None
 0.69A 5n0xB-3egwA:
1.2		 5n0xB-3egwA:
16.35
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.
3f41 PHYTASE

(Mitsuokella
multacida) 		PF14566
(PTPlike_phytase) 		3 SER A 401
ALA A 402
THR A 354
 None
 0.62A 5n0xB-3f41A:
undetectable		 5n0xB-3f41A:
21.19
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.
3ico 6-PHOSPHOGLUCONOLACT
ONASE

(Mycobacterium
tuberculosis) 		PF01182
(Glucosamine_iso) 		3 SER A 160
ALA A 162
THR A 185
 None
 0.75A 5n0xB-3icoA:
undetectable		 5n0xB-3icoA:
24.43
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.
3io0 ETUB PROTEIN

(Clostridium
kluyveri) 		PF00936
(BMC) 		3 SER A 287
ALA A 284
THR A 237
 None
 0.65A 5n0xB-3io0A:
undetectable		 5n0xB-3io0A:
18.73
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.
3kum DIPEPTIDE EPIMERASE

(Enterococcus
faecalis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 SER A  28
ALA A  29
THR A 297
 None
 0.62A 5n0xB-3kumA:
undetectable		 5n0xB-3kumA:
22.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3luf TWO-COMPONENT SYSTEM
RESPONSE
REGULATOR/GGDEF
DOMAIN PROTEIN

(Aeromonas
salmonicida) 		PF00072
(Response_reg) 		3 SER A 153
ALA A 152
THR A 161
 None
 0.70A 5n0xB-3lufA:
2.5		 5n0xB-3lufA:
22.54
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.
3mhu DIHYDROOROTATE
DEHYDROGENASE

(Leishmania
major) 		PF01180
(DHO_dh) 		3 SER A  36
ALA A  37
THR A 287
 None
 0.56A 5n0xB-3mhuA:
undetectable		 5n0xB-3mhuA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n7x CAPSID PROTEIN

(Decapod
penstyldensovirus
1) 		PF16530
(IHHNV_capsid) 		3 SER A  92
ALA A  93
THR A 227
 None
 0.55A 5n0xB-3n7xA:
undetectable		 5n0xB-3n7xA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nro LMO1026 PROTEIN

(Listeria
monocytogenes) 		PF03816
(LytR_cpsA_psr) 		3 SER A  80
ALA A  91
THR A 139
 None
 0.69A 5n0xB-3nroA:
undetectable		 5n0xB-3nroA:
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.
3pgb PUTATIVE
UNCHARACTERIZED
PROTEIN

(Aspergillus
nidulans) 		PF01179
(Cu_amine_oxid)
PF09248
(DUF1965) 		3 SER A 499
ALA A 432
THR A 450
 None
 0.69A 5n0xB-3pgbA:
undetectable		 5n0xB-3pgbA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qo6 PROTEASE DO-LIKE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		3 SER A 260
ALA A 261
THR A 298
 None
 0.75A 5n0xB-3qo6A:
undetectable		 5n0xB-3qo6A:
21.06
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.
3sxp ADP-L-GLYCERO-D-MANN
OHEPTOSE-6-EPIMERASE

(Helicobacter
pylori) 		PF01370
(Epimerase) 		3 SER A 138
ALA A 139
THR A 291
 NAD  A2402 (-3.3A)
None
None
 0.41A 5n0xB-3sxpA:
undetectable		 5n0xB-3sxpA:
21.18
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.
3t6g SH2
DOMAIN-CONTAINING
PROTEIN 3C

(Homo sapiens) 		PF00617
(RasGEF) 		3 SER A 500
ALA A 501
THR A 549
 None
 0.71A 5n0xB-3t6gA:
undetectable		 5n0xB-3t6gA:
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.
3u1s FAB PGT145 HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 SER H  25
ALA H  24
THR H  94
 None
 0.70A 5n0xB-3u1sH:
undetectable		 5n0xB-3u1sH:
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.
3u92 GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 3

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		3 SER A 122
ALA A 123
THR A 153
 None
 0.73A 5n0xB-3u92A:
undetectable		 5n0xB-3u92A:
23.47
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.
3vbo GENOME POLYPROTEIN,
CAPSID PROTEIN VP2

(Enterovirus A) 		PF00073
(Rhv) 		3 SER B 274
ALA B 275
THR B 156
 None
 0.53A 5n0xB-3vboB:
undetectable		 5n0xB-3vboB:
21.08
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.
3vv3 DESEASIN MCP-01

(Pseudoalteromonas
sp. SM9913) 		PF00082
(Peptidase_S8) 		3 SER A 115
ALA A 114
THR A 256
 None
 0.64A 5n0xB-3vv3A:
undetectable		 5n0xB-3vv3A:
24.00
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.
3zu0 NAD NUCLEOTIDASE

(Haemophilus
influenzae) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		3 SER A 149
ALA A 150
THR A 206
 None
 0.67A 5n0xB-3zu0A:
undetectable		 5n0xB-3zu0A:
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.
3zz1 BETA-D-GLUCOSIDE
GLUCOHYDROLASE

(Trichoderma
reesei) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 SER A 199
ALA A 198
THR A 299
 None
 0.68A 5n0xB-3zz1A:
undetectable		 5n0xB-3zz1A:
20.17
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.
4ap3 STEROID
MONOOXYGENASE

(Rhodococcus
rhodochrous) 		PF00743
(FMO-like) 		3 SER A 269
ALA A 270
THR A 309
 None
 0.60A 5n0xB-4ap3A:
undetectable		 5n0xB-4ap3A:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cyl EFF-1A

(Caenorhabditis
elegans) 		PF14884
(EFF-AFF) 		3 SER A 241
ALA A 240
THR A 187
 None
 0.76A 5n0xB-4cylA:
undetectable		 5n0xB-4cylA:
19.44
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.
4d72 GLYCOSIDE HYDROLASE

(Streptococcus
pneumoniae) 		PF08306
(Glyco_hydro_98M)
PF08307
(Glyco_hydro_98C) 		3 SER A 559
ALA A 524
THR A 531
 None
FUC  A2007 ( 4.0A)
None
 0.65A 5n0xB-4d72A:
undetectable		 5n0xB-4d72A:
19.87
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.
4ej0 ADP-L-GLYCERO-D-MANN
O-HEPTOSE-6-EPIMERAS
E

(Burkholderia
thailandensis) 		PF01370
(Epimerase) 		3 SER A 116
ALA A 117
THR A 296
 NAP  A 401 (-3.3A)
None
None
 0.35A 5n0xB-4ej0A:
undetectable		 5n0xB-4ej0A:
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.
4hu8 GH10 XYLANASE

(Globitermes
brachycerastes) 		PF00331
(Glyco_hydro_10)
PF02368
(Big_2) 		3 SER A  59
ALA A  58
THR A 105
 None
 0.74A 5n0xB-4hu8A:
undetectable		 5n0xB-4hu8A:
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.
4ihb DYSFERLIN

(Homo sapiens) 		PF00168
(C2) 		3 SER A 100
ALA A  99
THR A  94
 FMT  A 202 ( 4.7A)
None
None
 0.73A 5n0xB-4ihbA:
undetectable		 5n0xB-4ihbA:
16.54
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.
4kzy 40S RIBOSOMAL
PROTEIN S2

(Oryctolagus
cuniculus) 		PF00333
(Ribosomal_S5)
PF03719
(Ribosomal_S5_C) 		3 SER C 210
ALA C 211
THR C 215
 U  i1150 ( 4.4A)
C  i   4 ( 3.4A)
U  i   5 ( 3.4A)
 0.69A 5n0xB-4kzyC:
undetectable		 5n0xB-4kzyC:
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.
4m00 SERINE-RICH ADHESIN
FOR PLATELETS

(Staphylococcus
aureus) 		PF05345
(He_PIG) 		3 SER A 549
ALA A 548
THR A 497
 None
 0.69A 5n0xB-4m00A:
undetectable		 5n0xB-4m00A:
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.
4m01 SERINE-RICH ADHESIN
FOR PLATELETS

(Staphylococcus
aureus) 		no annotation 3 SER A 549
ALA A 548
THR A 497
 None
 0.74A 5n0xB-4m01A:
undetectable		 5n0xB-4m01A:
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.
4m02 SERINE-RICH ADHESIN
FOR PLATELETS

(Staphylococcus
aureus) 		PF05345
(He_PIG) 		3 SER A 549
ALA A 548
THR A 497
 None
 0.73A 5n0xB-4m02A:
undetectable		 5n0xB-4m02A:
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.
4nx9 FLAGELLIN

(Pseudomonas
aeruginosa) 		PF00669
(Flagellin_N)
PF00700
(Flagellin_C) 		3 SER A 248
ALA A 247
THR A 171
 None
 0.74A 5n0xB-4nx9A:
undetectable		 5n0xB-4nx9A:
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.
4ovx XYLOSE ISOMERASE
DOMAIN PROTEIN TIM
BARREL

(Planctopirus
limnophila) 		PF01261
(AP_endonuc_2) 		3 SER A 250
ALA A 251
THR A 301
 None
 0.33A 5n0xB-4ovxA:
undetectable		 5n0xB-4ovxA:
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.
4qvr UNCHARACTERIZED
HYPOTHETICAL PROTEIN
FTT_1539C

(Francisella
tularensis) 		no annotation 3 SER A  69
ALA A  70
THR A 100
 None
 0.47A 5n0xB-4qvrA:
undetectable		 5n0xB-4qvrA:
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.
4tt1 DENEDDYLASE

(Human
alphaherpesvirus
1) 		no annotation 3 SER A1703
ALA A1702
THR A1711
 None
 0.71A 5n0xB-4tt1A:
undetectable		 5n0xB-4tt1A:
16.83
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.
4w6w NBFEDF6

(Lama glama) 		PF07686
(V-set) 		3 SER B 825
ALA B 824
THR B 897
 None
 0.74A 5n0xB-4w6wB:
undetectable		 5n0xB-4w6wB:
15.50
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.
4wxx DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		3 SER A1418
ALA A1419
THR A1450
 None
 0.61A 5n0xB-4wxxA:
2.9		 5n0xB-4wxxA:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wy9 PUTATIVE MCP-TYPE
SIGNAL TRANSDUCTION
PROTEIN

(Campylobacter
jejuni) 		PF02743
(dCache_1) 		3 SER A 290
ALA A 289
THR A 314
 ACT  A 401 (-2.5A)
ACT  A 401 (-3.5A)
None
 0.55A 5n0xB-4wy9A:
undetectable		 5n0xB-4wy9A:
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.
4y8d NANOBODY

(Lama glama) 		PF07686
(V-set) 		3 SER C  25
ALA C  24
THR C  95
 None
 0.68A 5n0xB-4y8dC:
undetectable		 5n0xB-4y8dC:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yvs CAPSID PROTEIN VP0

(Enterovirus A) 		PF00073
(Rhv) 		3 SER C 205
ALA C 206
THR C  87
 None
 0.68A 5n0xB-4yvsC:
undetectable		 5n0xB-4yvsC:
23.36
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.
5abj VP2

(Enterovirus A) 		PF00073
(Rhv) 		3 SER B 205
ALA B 206
THR B  87
 None
 0.62A 5n0xB-5abjB:
undetectable		 5n0xB-5abjB:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bs5 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Acinetobacter
baumannii) 		PF00275
(EPSP_synthase) 		3 SER A 399
ALA A 400
THR A 427
 None
 0.74A 5n0xB-5bs5A:
undetectable		 5n0xB-5bs5A:
23.20
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.
5bul FLAVIN-DEPENDENT
HALOGENASE TRIPLE
MUTANT

(Streptomyces) 		PF04820
(Trp_halogenase) 		3 SER A 305
ALA A  53
THR A  96
 None
 0.68A 5n0xB-5bulA:
undetectable		 5n0xB-5bulA:
23.68
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.
5c8c VP0

(Enterovirus A) 		PF00073
(Rhv)
PF02226
(Pico_P1A) 		3 SER B 274
ALA B 275
THR B 156
 None
 0.58A 5n0xB-5c8cB:
undetectable		 5n0xB-5c8cB:
22.05
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.
5d9a RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza C
virus) 		PF00602
(Flu_PB1) 		3 SER B 455
ALA B 454
THR B 463
 None
 0.74A 5n0xB-5d9aB:
undetectable		 5n0xB-5d9aB:
20.32
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.
5e4m HYDROXYNITRILE LYASE

(Davallia
tyermannii) 		no annotation 3 SER A  77
ALA A  76
THR A 109
 None
 0.72A 5n0xB-5e4mA:
undetectable		 5n0xB-5e4mA:
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.
5fbz ENZYME SUBTILASE
SUBHAL FROM BACILLUS
HALMAPALUS

(Bacillus
halmapalus) 		PF00082
(Peptidase_S8)
PF04151
(PPC) 		3 SER A 141
ALA A 175
THR A 180
 None
 0.71A 5n0xB-5fbzA:
1.0		 5n0xB-5fbzA:
23.01
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.
5hke BILE SALT HYDROLASE

(Lactobacillus
salivarius) 		PF02275
(CBAH) 		3 SER A 231
ALA A 228
THR A   3
 None
None
OCS  A   2 ( 3.8A)
 0.73A 5n0xB-5hkeA:
undetectable		 5n0xB-5hkeA:
20.32
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.
5j4u GLUTATHIONE
TRANSFERASE FAMILY
PROTEIN

(Populus
trichocarpa) 		PF02798
(GST_N)
PF13410
(GST_C_2) 		3 SER A  82
ALA A  83
THR A 150
 None
 0.76A 5n0xB-5j4uA:
undetectable		 5n0xB-5j4uA:
19.81
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.
5js9 GP41

(Human
immunodeficiency
virus 1) 		PF00517
(GP41) 		3 SER D 528
ALA D 525
THR D 536
 None
 0.70A 5n0xB-5js9D:
undetectable		 5n0xB-5js9D:
18.54
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.
5jzd ISOCHORISMATE
SYNTHASE ENTC

(Escherichia
coli) 		PF00425
(Chorismate_bind) 		3 SER A  87
ALA A  77
THR A 345
 None
 0.69A 5n0xB-5jzdA:
undetectable		 5n0xB-5jzdA:
23.76
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.
5lae PEROXISOMAL
N(1)-ACETYL-SPERMINE
/SPERMIDINE
OXIDASE,PEROXISOMAL
N(1)-ACETYL-SPERMINE
/SPERMIDINE OXIDASE

(Mus musculus) 		PF01593
(Amino_oxidase) 		3 SER A  41
ALA A  42
THR A 222
 None
 0.70A 5n0xB-5laeA:
undetectable		 5n0xB-5laeA:
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.
5lb8 ATP-DEPENDENT DNA
HELICASE Q5

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16124
(RecQ_Zn_bind) 		3 SER A 339
ALA A 341
THR A 194
 None
 0.70A 5n0xB-5lb8A:
undetectable		 5n0xB-5lb8A:
24.73
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.
5lfd ALLANTOIN RACEMASE

(Pseudomonas
fluorescens) 		no annotation 3 SER A 142
ALA A 141
THR A 119
 None
 0.71A 5n0xB-5lfdA:
2.6		 5n0xB-5lfdA:
20.44
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.
5lkz HISTONE
ACETYLTRANSFERASE
P300,HISTONE
ACETYLTRANSFERASE
P300

(Homo sapiens) 		PF00439
(Bromodomain)
PF06001
(DUF902)
PF08214
(HAT_KAT11) 		3 SER A1289
ALA A1290
THR A1322
 None
 0.70A 5n0xB-5lkzA:
undetectable		 5n0xB-5lkzA:
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.
5lm8 'MULTICOPPER OXIDASE

(Aspergillus
niger) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 SER A 270
ALA A 269
THR A 174
 None
 0.60A 5n0xB-5lm8A:
undetectable		 5n0xB-5lm8A:
21.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n0o PEPTIDE
N-METHYLTRANSFERASE

(Omphalotus
olearius) 		no annotation 3 SER A 129
ALA A 130
THR A 245
 SAM  A 501 (-4.7A)
SAM  A 501 (-3.2A)
SAM  A 501 (-3.6A)
 0.00A 5n0xB-5n0oA:
45.7		 5n0xB-5n0oA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oj2 MAM
DOMAIN-CONTAINING
GLYCOSYLPHOSPHATIDYL
INOSITOL ANCHOR
PROTEIN 1

(Gallus gallus) 		PF13927
(Ig_3) 		3 SER A 625
ALA A 626
THR A 719
 None
 0.69A 5n0xB-5oj2A:
undetectable		 5n0xB-5oj2A:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oy9 GLYCOPROTEIN G

(Indiana
vesiculovirus) 		no annotation 3 SER A 260
ALA A 261
THR A 312
 None
 0.67A 5n0xB-5oy9A:
undetectable		 5n0xB-5oy9A:
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.
5unc PHOSPHOENOLPYRUVATE
PHOSPHOMUTASE

(Streptomyces
platensis) 		PF13714
(PEP_mutase) 		3 SER A 235
ALA A 236
THR A  33
 None
 0.73A 5n0xB-5uncA:
undetectable		 5n0xB-5uncA:
23.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v1w GLYCOSIDE HYDROLASE

(Bacillus
halodurans) 		PF03639
(Glyco_hydro_81) 		3 SER A 318
ALA A 317
THR A 286
 None
None
EDO  A 818 (-4.2A)
 0.74A 5n0xB-5v1wA:
undetectable		 5n0xB-5v1wA:
19.87
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.
5vj7 OXIDOREDUCTASE

(Pyrococcus
furiosus) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		3 SER A 267
ALA A 268
THR A 304
 None
None
FAD  A 503 (-2.0A)
 0.73A 5n0xB-5vj7A:
undetectable		 5n0xB-5vj7A:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b9s METHYLPHOSPHONATE
SYNTHASE

(Nitrosopumilus
maritimus) 		no annotation 3 SER A 245
ALA A 242
THR A 307
 None
 0.75A 5n0xB-6b9sA:
undetectable		 5n0xB-6b9sA:
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.
6f42 DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC1

(Saccharomyces
cerevisiae) 		no annotation 3 SER A  19
ALA A  20
THR A 255
 None
 0.65A 5n0xB-6f42A:
undetectable		 5n0xB-6f42A:
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.
6f9m SERINE PROTEASE

(Planococcus
plakortidis) 		no annotation 3 SER A  97
ALA A  96
THR A 238
 None
NA  A 402 ( 4.7A)
None
 0.57A 5n0xB-6f9mA:
1.6		 5n0xB-6f9mA:
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.
6fik POLYKETIDE SYNTHASE

(Cercospora
nicotianae) 		no annotation 3 SER A1218
ALA A1217
THR A1202
 None
 0.53A 5n0xB-6fikA:
1.8		 5n0xB-6fikA:
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.
6fvs CYS-LOOP
LIGAND-GATED ION
CHANNEL

(endosymbiont of
Tevnia
jerichonana) 		no annotation 3 SER A 183
ALA A 182
THR A 178
 None
 0.69A 5n0xB-6fvsA:
undetectable		 5n0xB-6fvsA:
undetectable