SIMILAR PATTERNS OF AMINO ACIDS FOR 4EB6_C_VLBC503

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.
1a97 XANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Escherichia
coli) 		PF00156
(Pribosyltran) 		5 VAL A  41
THR A 111
ILE A  52
VAL A  55
ILE A  33
 None
 1.33A 4eb6B-1a97A:
undetectable
4eb6C-1a97A:
undetectable		 4eb6B-1a97A:
16.46
4eb6C-1a97A:
14.93
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.
1c8o ICE INHIBITOR

(Cowpox virus) 		PF00079
(Serpin) 		5 VAL A  46
THR A  38
TYR A  32
ILE A   3
LYS A   1
 None
 1.28A 4eb6B-1c8oA:
undetectable
4eb6C-1c8oA:
undetectable		 4eb6B-1c8oA:
21.73
4eb6C-1c8oA:
23.48
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.
1c9l CLATHRIN

(Rattus
norvegicus) 		PF01394
(Clathrin_propel)
PF09268
(Clathrin-link) 		5 VAL A 273
TYR A 285
PRO A   6
ILE A 298
VAL A 327
 None
 1.28A 4eb6B-1c9lA:
undetectable
4eb6C-1c9lA:
undetectable		 4eb6B-1c9lA:
21.91
4eb6C-1c9lA:
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.
1ebd DIHYDROLIPOAMIDE
DEHYDROGENASE

(Geobacillus
stearothermophilus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 THR A 200
PRO A 176
ILE A 182
VAL A 252
ILE A 263
 None
 1.46A 4eb6B-1ebdA:
undetectable
4eb6C-1ebdA:
undetectable		 4eb6B-1ebdA:
21.05
4eb6C-1ebdA:
22.49
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.
1f76 DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)

(Escherichia
coli) 		PF01180
(DHO_dh) 		5 THR A 334
PRO A  43
ILE A 308
VAL A 315
ILE A 317
 None
 1.42A 4eb6B-1f76A:
undetectable
4eb6C-1f76A:
undetectable		 4eb6B-1f76A:
19.78
4eb6C-1f76A:
23.18
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.
1ffv CUTL, MOLYBDOPROTEIN
OF CARBON MONOXIDE
DEHYDROGENASE

(Hydrogenophaga
pseudoflava) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 PRO B 363
ASN B 418
ILE B 414
VAL B 400
ILE B 396
 None
 1.23A 4eb6B-1ffvB:
undetectable
4eb6C-1ffvB:
undetectable		 4eb6B-1ffvB:
19.59
4eb6C-1ffvB:
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.
1gvf TAGATOSE-BISPHOSPHAT
E ALDOLASE AGAY

(Escherichia
coli) 		PF01116
(F_bP_aldolase) 		5 ASP A 215
PRO A  21
ILE A 222
VAL A 277
ILE A 275
 None
 1.30A 4eb6B-1gvfA:
undetectable
4eb6C-1gvfA:
undetectable		 4eb6B-1gvfA:
21.93
4eb6C-1gvfA:
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.
1hqz ACTIN-BINDING
PROTEIN

(Saccharomyces
cerevisiae) 		PF00241
(Cofilin_ADF) 		5 VAL 1  23
TYR 1  19
ILE 1 135
VAL 1 116
ILE 1  84
 None
 1.43A 4eb6B-1hqz1:
undetectable
4eb6C-1hqz1:
undetectable		 4eb6B-1hqz1:
16.85
4eb6C-1hqz1:
15.73
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.
1io0 TROPOMODULIN

(Gallus gallus) 		no annotation 5 ASP A 182
PRO A 209
ASN A 207
ILE A 205
VAL A 183
 None
 1.11A 4eb6B-1io0A:
undetectable
4eb6C-1io0A:
undetectable		 4eb6B-1io0A:
17.78
4eb6C-1io0A:
19.52
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.
1k7j PROTEIN YCIO

(Escherichia
coli) 		PF01300
(Sua5_yciO_yrdC) 		5 VAL A  24
ASP A 169
ILE A 171
VAL A 168
ILE A  56
 None
 1.21A 4eb6B-1k7jA:
undetectable
4eb6C-1k7jA:
undetectable		 4eb6B-1k7jA:
18.16
4eb6C-1k7jA:
19.46
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.
1ktn 2-DEOXYRIBOSE-5-PHOS
PHATE ALDOLASE

(Escherichia
coli) 		PF01791
(DeoC) 		5 ASP A  24
PRO A  54
ILE A  46
VAL A  29
ILE A  55
 None
 1.35A 4eb6B-1ktnA:
undetectable
4eb6C-1ktnA:
undetectable		 4eb6B-1ktnA:
17.81
4eb6C-1ktnA:
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.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 TYR A 226
THR A 160
ILE A 117
VAL A  34
ILE A  32
 None
 1.17A 4eb6B-1mjfA:
2.0
4eb6C-1mjfA:
undetectable		 4eb6B-1mjfA:
21.43
4eb6C-1mjfA:
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.
1mkm ICLR TRANSCRIPTIONAL
REGULATOR

(Thermotoga
maritima) 		PF01614
(IclR)
PF09339
(HTH_IclR) 		5 ASP A 203
PRO A 200
ILE A  77
VAL A 209
ILE A 139
 None
 1.44A 4eb6B-1mkmA:
undetectable
4eb6C-1mkmA:
undetectable		 4eb6B-1mkmA:
19.55
4eb6C-1mkmA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ogo DEXTRANASE

(Talaromyces
minioluteus) 		PF03718
(Glyco_hydro_49)
PF17433
(Glyco_hydro_49N) 		5 VAL X 368
PRO X 345
PRO X 378
VAL X 389
ILE X 362
 None
 1.35A 4eb6B-1ogoX:
undetectable
4eb6C-1ogoX:
undetectable		 4eb6B-1ogoX:
21.63
4eb6C-1ogoX:
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.
1ox4 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
HISHF

(Saccharomyces
cerevisiae) 		PF00117
(GATase)
PF00977
(His_biosynth) 		5 THR B 384
TYR B 374
PRO B 386
VAL B 399
ILE B 363
 None
 1.41A 4eb6B-1ox4B:
undetectable
4eb6C-1ox4B:
undetectable		 4eb6B-1ox4B:
22.70
4eb6C-1ox4B:
22.41
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.
1qvp DIPHTHERIA TOXIN
REPRESSOR

(Corynebacterium
diphtheriae) 		PF04023
(FeoA) 		5 VAL A 166
THR A 220
ILE A 187
VAL A 193
ILE A 195
 None
 1.20A 4eb6B-1qvpA:
undetectable
4eb6C-1qvpA:
undetectable		 4eb6B-1qvpA:
11.94
4eb6C-1qvpA:
11.35
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.
1t06 HYPOTHETICAL PROTEIN

(Bacillus cereus) 		PF08713
(DNA_alkylation) 		5 VAL A 190
ASN A 172
ILE A 160
VAL A 196
ILE A 198
 None
 1.21A 4eb6B-1t06A:
undetectable
4eb6C-1t06A:
undetectable		 4eb6B-1t06A:
18.81
4eb6C-1t06A:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ulz PYRUVATE CARBOXYLASE
N-TERMINAL DOMAIN

(Aquifex
aeolicus) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 VAL A  15
PRO A  79
ILE A 312
VAL A   5
ILE A  77
 None
 1.33A 4eb6B-1ulzA:
undetectable
4eb6C-1ulzA:
undetectable		 4eb6B-1ulzA:
22.81
4eb6C-1ulzA:
23.21
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.
1vjn ZN-DEPENDENT
HYDROLASE OF
METALLO-BETA-LACTAMA
SE SUPERFAMILY
TM0207

(Thermotoga
maritima) 		PF13483
(Lactamase_B_3) 		5 PRO A 173
PRO A 142
ILE A 157
VAL A 132
ILE A 140
 None
 1.45A 4eb6B-1vjnA:
undetectable
4eb6C-1vjnA:
undetectable		 4eb6B-1vjnA:
19.31
4eb6C-1vjnA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xpo RHO TRANSCRIPTION
TERMINATION FACTOR

(Escherichia
coli) 		PF00006
(ATP-synt_ab)
PF07497
(Rho_RNA_bind)
PF07498
(Rho_N) 		5 VAL A  54
ASP A  52
TYR A  72
ILE A 101
ILE A  35
 None
 1.21A 4eb6B-1xpoA:
undetectable
4eb6C-1xpoA:
3.4		 4eb6B-1xpoA:
23.64
4eb6C-1xpoA:
22.29
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.
1zuw GLUTAMATE RACEMASE 1

(Bacillus
subtilis) 		PF01177
(Asp_Glu_race) 		5 VAL A  93
PRO A   5
ILE A  22
VAL A   8
ILE A  32
 None
 1.25A 4eb6B-1zuwA:
undetectable
4eb6C-1zuwA:
undetectable		 4eb6B-1zuwA:
20.94
4eb6C-1zuwA:
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.
2ap9 ACETYLGLUTAMATE
KINASE

(Mycobacterium
tuberculosis) 		PF00696
(AA_kinase) 		5 VAL A 189
ASP A 185
THR A  96
PRO A  97
ILE A 193
 None
 1.43A 4eb6B-2ap9A:
undetectable
4eb6C-2ap9A:
2.2		 4eb6B-2ap9A:
20.70
4eb6C-2ap9A:
20.91
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.
2d0d 2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		5 THR A  17
PRO A  60
ILE A  48
VAL A  57
ILE A  29
 None
 1.44A 4eb6B-2d0dA:
undetectable
4eb6C-2d0dA:
3.2		 4eb6B-2d0dA:
23.41
4eb6C-2d0dA:
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.
2eo5 419AA LONG
HYPOTHETICAL
AMINOTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00202
(Aminotran_3) 		5 TYR A 227
THR A  48
PRO A 396
ASN A  55
VAL A 334
 None
 1.41A 4eb6B-2eo5A:
undetectable
4eb6C-2eo5A:
2.7		 4eb6B-2eo5A:
22.25
4eb6C-2eo5A:
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.
2f57 SERINE/THREONINE-PRO
TEIN KINASE PAK 7

(Homo sapiens) 		PF00069
(Pkinase) 		5 VAL A 710
THR A 538
ILE A 574
VAL A 548
ILE A 545
 None
 1.37A 4eb6B-2f57A:
undetectable
4eb6C-2f57A:
undetectable		 4eb6B-2f57A:
21.40
4eb6C-2f57A:
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.
2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Elizabethkingia
meningoseptica) 		PF01408
(GFO_IDH_MocA) 		5 ASP A  44
TYR A 444
TYR A 377
VAL A  21
ILE A  23
 None
MRD  A1447 (-4.6A)
None
None
None
 1.42A 4eb6B-2ixbA:
undetectable
4eb6C-2ixbA:
3.6		 4eb6B-2ixbA:
20.66
4eb6C-2ixbA:
21.58
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.
2r6f EXCINUCLEASE ABC
SUBUNIT A

(Geobacillus
stearothermophilus) 		PF00005
(ABC_tran) 		5 VAL A 101
ASP A 106
THR A 477
ILE A 461
ILE A 426
 None
 1.26A 4eb6B-2r6fA:
undetectable
4eb6C-2r6fA:
undetectable		 4eb6B-2r6fA:
19.49
4eb6C-2r6fA:
18.55
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.
2v7y CHAPERONE PROTEIN
DNAK

(Geobacillus
kaustophilus) 		PF00012
(HSP70) 		5 THR A 147
PRO A 146
TYR A 119
ILE A   7
ILE A 142
 None
 1.34A 4eb6B-2v7yA:
undetectable
4eb6C-2v7yA:
undetectable		 4eb6B-2v7yA:
21.58
4eb6C-2v7yA:
21.51
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.
2wz8 CELLULOSOME PROTEIN
DOCKERIN TYPE I

(Ruminiclostridium
thermocellum) 		PF03422
(CBM_6) 		5 ASP A 117
THR A 113
ILE A  90
VAL A 118
ILE A 146
 None
 1.41A 4eb6B-2wz8A:
undetectable
4eb6C-2wz8A:
undetectable		 4eb6B-2wz8A:
15.11
4eb6C-2wz8A:
14.57
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.
2y24 XYLANASE

(Dickeya
chrysanthemi) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		5 TYR A 286
THR A 235
PRO A 236
ILE A 269
VAL A 352
 None
None
None
PG4  A1414 (-3.8A)
None
 0.98A 4eb6B-2y24A:
undetectable
4eb6C-2y24A:
2.7		 4eb6B-2y24A:
21.71
4eb6C-2y24A:
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.
2zbt PYRIDOXAL
BIOSYNTHESIS LYASE
PDXS

(Thermus
thermophilus) 		PF01680
(SOR_SNZ) 		5 VAL A  45
ASP A 102
ILE A 104
VAL A 101
ILE A  99
 None
 1.25A 4eb6B-2zbtA:
undetectable
4eb6C-2zbtA:
undetectable		 4eb6B-2zbtA:
21.12
4eb6C-2zbtA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zyg 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING

(Klebsiella
pneumoniae) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 THR A 134
PRO A 138
ILE A 123
VAL A 152
ILE A   6
 None
 1.16A 4eb6B-2zygA:
undetectable
4eb6C-2zygA:
3.9		 4eb6B-2zygA:
22.37
4eb6C-2zygA:
22.83
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.
3c24 PUTATIVE
OXIDOREDUCTASE

(Jannaschia sp.
CCS1) 		PF03807
(F420_oxidored)
PF16896
(PGDH_C) 		5 VAL A  82
PRO A 110
PRO A 104
ILE A 282
ILE A 119
 None
 1.43A 4eb6B-3c24A:
undetectable
4eb6C-3c24A:
3.3		 4eb6B-3c24A:
20.95
4eb6C-3c24A:
20.63
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.
3dad FH1/FH2
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		no annotation 5 VAL A  16
THR A 109
PRO A 108
TYR A  99
ILE A  55
 None
 1.37A 4eb6B-3dadA:
undetectable
4eb6C-3dadA:
undetectable		 4eb6B-3dadA:
22.98
4eb6C-3dadA:
22.29
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.
3dhv D-ALANINE-POLY(PHOSP
HORIBITOL) LIGASE

(Bacillus cereus) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 ASP A  37
THR A  14
PRO A  15
ILE A  66
ILE A   7
 None
 1.32A 4eb6B-3dhvA:
1.9
4eb6C-3dhvA:
undetectable		 4eb6B-3dhvA:
22.04
4eb6C-3dhvA:
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.
3e96 DIHYDRODIPICOLINATE
SYNTHASE

(Bacillus
clausii) 		PF00701
(DHDPS) 		5 THR A  21
PRO A  22
PRO A  19
ASN A 217
ILE A  50
 None
 1.40A 4eb6B-3e96A:
undetectable
4eb6C-3e96A:
undetectable		 4eb6B-3e96A:
21.81
4eb6C-3e96A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3exs RMPD
(HEXULOSE-6-PHOSPHAT
E SYNTHASE)

(Streptococcus
mutans) 		PF00215
(OMPdecase) 		5 ASP A  32
THR A 174
ILE A  34
VAL A  31
ILE A 199
 None
5RP  A 501 (-3.7A)
None
None
None
 1.42A 4eb6B-3exsA:
undetectable
4eb6C-3exsA:
undetectable		 4eb6B-3exsA:
18.43
4eb6C-3exsA:
19.31
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.
3gov MASP-1

(Homo sapiens) 		PF00089
(Trypsin) 		5 THR B 460
PRO B 461
PRO B 649
ILE B 684
VAL B 486
 None
 1.06A 4eb6B-3govB:
undetectable
4eb6C-3govB:
undetectable		 4eb6B-3govB:
17.73
4eb6C-3govB:
19.41
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.
3hmj FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00109
(ketoacyl-synt)
PF01648
(ACPS)
PF02801
(Ketoacyl-synt_C) 		5 THR A1300
PRO A1301
ASN A1245
ILE A1292
VAL A1219
 None
 1.09A 4eb6B-3hmjA:
4.1
4eb6C-3hmjA:
4.4		 4eb6B-3hmjA:
13.02
4eb6C-3hmjA:
12.39
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.
3hxj PYRROLO-QUINOLINE
QUINONE

(Methanococcus
maripaludis) 		PF01011
(PQQ)
PF13360
(PQQ_2)
PF13570
(PQQ_3) 		5 THR A 218
TYR A 191
PRO A 260
ILE A 302
ILE A 268
 None
 1.03A 4eb6B-3hxjA:
undetectable
4eb6C-3hxjA:
undetectable		 4eb6B-3hxjA:
20.67
4eb6C-3hxjA:
20.63
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.
3j81 US2

(Kluyveromyces
lactis) 		PF00318
(Ribosomal_S2) 		5 ASP A 157
PRO A 161
ILE A 133
VAL A 143
ILE A 122
 None
 1.19A 4eb6B-3j81A:
undetectable
4eb6C-3j81A:
undetectable		 4eb6B-3j81A:
20.18
4eb6C-3j81A:
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.
3k4w UNCHARACTERIZED
PROTEIN BB4693

(Bordetella
bronchiseptica) 		PF04909
(Amidohydro_2) 		5 VAL A  83
PRO A  88
ILE A 119
VAL A  63
ILE A   4
 None
 1.45A 4eb6B-3k4wA:
undetectable
4eb6C-3k4wA:
undetectable		 4eb6B-3k4wA:
19.46
4eb6C-3k4wA:
20.73
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.
3num SERINE PROTEASE
HTRA1

(Homo sapiens) 		PF13365
(Trypsin_2) 		5 THR A 293
ASN A 343
ILE A 342
VAL A 339
ILE A 179
 None
 1.41A 4eb6B-3numA:
undetectable
4eb6C-3numA:
undetectable		 4eb6B-3numA:
18.78
4eb6C-3numA:
20.09
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.
3pih UVRABC SYSTEM
PROTEIN A

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		5 VAL A 101
ASP A 106
THR A 457
ILE A 441
ILE A 406
 None
 1.24A 4eb6B-3pihA:
undetectable
4eb6C-3pihA:
undetectable		 4eb6B-3pihA:
19.98
4eb6C-3pihA:
19.14
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.
3syj ADHESION AND
PENETRATION PROTEIN
AUTOTRANSPORTER

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		5 VAL A 105
TYR A 102
PRO A 144
ILE A 179
ILE A 156
 None
 1.42A 4eb6B-3syjA:
undetectable
4eb6C-3syjA:
undetectable		 4eb6B-3syjA:
18.97
4eb6C-3syjA:
17.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3td9 BRANCHED CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN

(Thermotoga
maritima) 		PF13458
(Peripla_BP_6) 		5 VAL A 168
ASP A 161
THR A 118
ILE A 221
ILE A  33
 None
None
PHE  A 400 (-2.8A)
None
None
 1.33A 4eb6B-3td9A:
3.7
4eb6C-3td9A:
2.8		 4eb6B-3td9A:
21.14
4eb6C-3td9A:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ttk POLYAMINE TRANSPORT
PROTEIN

(Pseudomonas
aeruginosa) 		PF13416
(SBP_bac_8) 		5 TYR A  38
TYR A  57
ILE A 129
VAL A 293
ILE A 279
 None
 1.40A 4eb6B-3ttkA:
undetectable
4eb6C-3ttkA:
undetectable		 4eb6B-3ttkA:
21.27
4eb6C-3ttkA:
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.
3ty7 PUTATIVE ALDEHYDE
DEHYDROGENASE
SAV2122

(Staphylococcus
aureus) 		PF00171
(Aldedh) 		5 ASP A 257
THR A 389
ILE A 412
VAL A 258
ILE A 260
 None
 1.43A 4eb6B-3ty7A:
undetectable
4eb6C-3ty7A:
undetectable		 4eb6B-3ty7A:
22.24
4eb6C-3ty7A:
23.45
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.
3ubm FORMYL-COA:OXALATE
COA-TRANSFERASE

(Acetobacter
aceti) 		PF02515
(CoA_transf_3) 		5 TYR A 117
ILE A 433
LYS A 431
VAL A  88
ILE A  42
 None
 1.41A 4eb6B-3ubmA:
undetectable
4eb6C-3ubmA:
3.2		 4eb6B-3ubmA:
20.93
4eb6C-3ubmA:
23.11
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.
3upn PENICILLIN-BINDING
PROTEIN A

(Mycobacterium
tuberculosis) 		PF00905
(Transpeptidase) 		5 VAL A 162
THR A 345
PRO A 346
ASN A 211
VAL A  87
 None
 1.42A 4eb6B-3upnA:
undetectable
4eb6C-3upnA:
undetectable		 4eb6B-3upnA:
25.24
4eb6C-3upnA:
23.75
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.
3vc7 PUTATIVE
OXIDOREDUCTASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 VAL A 164
THR A 236
ILE A  87
VAL A 120
ILE A 127
 None
 1.41A 4eb6B-3vc7A:
6.6
4eb6C-3vc7A:
6.1		 4eb6B-3vc7A:
21.06
4eb6C-3vc7A:
23.23
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.
3vue GRANULE-BOUND STARCH
SYNTHASE 1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Oryza sativa) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 VAL A 550
THR A 499
PRO A 500
ILE A 400
ILE A 432
 None
 1.20A 4eb6B-3vueA:
4.8
4eb6C-3vueA:
3.6		 4eb6B-3vueA:
21.48
4eb6C-3vueA:
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.
3vue GRANULE-BOUND STARCH
SYNTHASE 1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Oryza sativa) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 VAL A 550
THR A 499
PRO A 500
VAL A 430
ILE A 432
 None
 1.36A 4eb6B-3vueA:
4.8
4eb6C-3vueA:
3.6		 4eb6B-3vueA:
21.48
4eb6C-3vueA:
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.
4ecn LEUCINE-RICH REPEAT
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF14660
(DUF4458) 		5 TYR A 415
TYR A 482
ASN A 553
ILE A 556
ILE A 493
 None
 1.44A 4eb6B-4ecnA:
undetectable
4eb6C-4ecnA:
undetectable		 4eb6B-4ecnA:
19.84
4eb6C-4ecnA:
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.
4eyc CATHELICIDIN
ANTIMICROBIAL
PEPTIDE

(Homo sapiens) 		PF00666
(Cathelicidins) 		5 THR A  90
PRO A  87
ASN A  47
ILE A  46
VAL A  81
 None
 1.27A 4eb6B-4eycA:
undetectable
4eb6C-4eycA:
undetectable		 4eb6B-4eycA:
14.77
4eb6C-4eycA:
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.
4fie SERINE/THREONINE-PRO
TEIN KINASE PAK 4

(Homo sapiens) 		PF00069
(Pkinase)
PF00786
(PBD) 		5 VAL A 509
THR A 408
ILE A 581
VAL A 420
ILE A 446
 None
 1.26A 4eb6B-4fieA:
undetectable
4eb6C-4fieA:
undetectable		 4eb6B-4fieA:
22.91
4eb6C-4fieA:
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.
4fie SERINE/THREONINE-PRO
TEIN KINASE PAK 4

(Homo sapiens) 		PF00069
(Pkinase)
PF00786
(PBD) 		5 VAL A 582
THR A 410
ILE A 446
VAL A 420
ILE A 417
 None
 1.36A 4eb6B-4fieA:
undetectable
4eb6C-4fieA:
undetectable		 4eb6B-4fieA:
22.91
4eb6C-4fieA:
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.
4fir PYRIDOXAL
BIOSYNTHESIS LYASE
PDXS

(Pyrococcus
horikoshii) 		PF01680
(SOR_SNZ)
PF05690
(ThiG) 		5 VAL A 167
ASN A 252
ILE A 152
VAL A 173
ILE A 177
 None
 1.21A 4eb6B-4firA:
undetectable
4eb6C-4firA:
undetectable		 4eb6B-4firA:
20.09
4eb6C-4firA:
21.12
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.
4gt6 CELL SURFACE PROTEIN

(Faecalibacterium
prausnitzii) 		PF13306
(LRR_5) 		5 PRO A  76
PRO A  98
ILE A 104
VAL A 128
ILE A 120
 None
None
None
None
EDO  A 911 (-4.2A)
 1.42A 4eb6B-4gt6A:
undetectable
4eb6C-4gt6A:
undetectable		 4eb6B-4gt6A:
22.15
4eb6C-4gt6A:
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.
4hxt DE NOVO PROTEIN
OR329

(synthetic
construct) 		PF00514
(Arm) 		5 VAL A 167
PRO A 201
PRO A 159
VAL A 125
ILE A 121
 None
 1.45A 4eb6B-4hxtA:
undetectable
4eb6C-4hxtA:
undetectable		 4eb6B-4hxtA:
19.96
4eb6C-4hxtA:
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.
4igd MANNAN-BINDING
LECTIN SERINE
PROTEASE 1

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		5 THR A 460
PRO A 461
PRO A 649
ILE A 684
VAL A 486
 None
 1.05A 4eb6B-4igdA:
undetectable
4eb6C-4igdA:
undetectable		 4eb6B-4igdA:
20.83
4eb6C-4igdA:
22.36
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.
4il5 CYSTEINE SYNTHASE

(Entamoeba
histolytica) 		PF00291
(PALP) 		5 ASP A 273
THR A 301
ILE A 285
VAL A  32
ILE A  38
 None
 1.42A 4eb6B-4il5A:
2.3
4eb6C-4il5A:
undetectable		 4eb6B-4il5A:
22.08
4eb6C-4il5A:
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.
4jqr HYPOTHETICAL PROTEIN

(Bacteroides
caccae) 		PF14717
(DUF4465) 		5 VAL A 115
PRO A 221
ASN A 144
ILE A 102
ILE A 204
 None
 1.28A 4eb6B-4jqrA:
undetectable
4eb6C-4jqrA:
undetectable		 4eb6B-4jqrA:
19.05
4eb6C-4jqrA:
18.89
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.
4kp2 HOMOACONITASE LARGE
SUBUNIT

(Methanocaldococcus
jannaschii) 		PF00330
(Aconitase) 		5 VAL A 220
THR A 206
ILE A 179
VAL A 157
ILE A 159
 None
 1.10A 4eb6B-4kp2A:
undetectable
4eb6C-4kp2A:
undetectable		 4eb6B-4kp2A:
20.48
4eb6C-4kp2A:
20.73
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.
4ktp GLYCOSIDE HYDROLASE
FAMILY 65 CENTRAL
CATALYTIC

([Bacillus]
selenitireducens) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		5 VAL A 430
PRO A 348
TYR A 345
ILE A 437
VAL A 424
 None
 1.30A 4eb6B-4ktpA:
2.1
4eb6C-4ktpA:
undetectable		 4eb6B-4ktpA:
20.39
4eb6C-4ktpA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mjk CRISPR PROTEIN

(Archaeoglobus
fulgidus) 		PF09704
(Cas_Cas5d) 		5 THR A  34
PRO A  33
TYR A  30
VAL A   6
ILE A 147
 None
 1.42A 4eb6B-4mjkA:
undetectable
4eb6C-4mjkA:
undetectable		 4eb6B-4mjkA:
19.96
4eb6C-4mjkA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q88 UNCHARACTERIZED
PROTEIN

(Bacteroides
vulgatus) 		PF07470
(Glyco_hydro_88) 		5 TYR A 320
THR A 293
ILE A 358
VAL A  37
ILE A  34
 None
 1.39A 4eb6B-4q88A:
undetectable
4eb6C-4q88A:
undetectable		 4eb6B-4q88A:
23.28
4eb6C-4q88A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qiw DNA-DIRECTED RNA
POLYMERASE

(Thermococcus
kodakarensis) 		PF00562
(RNA_pol_Rpb2_6)
PF00623
(RNA_pol_Rpb1_2)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		5 ASP B 911
TYR B 731
THR A 667
ILE B 908
VAL B 725
 None
 1.45A 4eb6B-4qiwB:
undetectable
4eb6C-4qiwB:
undetectable		 4eb6B-4qiwB:
18.16
4eb6C-4qiwB:
18.29
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.
4r3u 2-HYDROXYISOBUTYRYL-
COA MUTASE LARGE
SUBUNIT

(Aquincola
tertiaricarbonis) 		PF01642
(MM_CoA_mutase) 		5 VAL A 268
THR A 260
ILE A 436
VAL A 219
ILE A 201
 None
 1.12A 4eb6B-4r3uA:
2.1
4eb6C-4r3uA:
undetectable		 4eb6B-4r3uA:
21.71
4eb6C-4r3uA:
22.49
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.
4tn5 FRUCTOSE-LIKE
PHOSPHOTRANSFERASE
ENZYME IIB COMPONENT
3

(Escherichia
coli) 		PF02302
(PTS_IIB) 		5 VAL A  80
THR A  64
ILE A  54
VAL A   5
ILE A  37
 None
 1.44A 4eb6B-4tn5A:
2.5
4eb6C-4tn5A:
undetectable		 4eb6B-4tn5A:
13.54
4eb6C-4tn5A:
14.03
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.
4twb RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE

(Sulfolobus
solfataricus) 		PF00156
(Pribosyltran)
PF13793
(Pribosyltran_N) 		5 THR A  56
PRO A  87
ILE A 245
VAL A 283
ILE A 287
 None
 1.25A 4eb6B-4twbA:
3.6
4eb6C-4twbA:
undetectable		 4eb6B-4twbA:
20.05
4eb6C-4twbA:
23.35
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.
4wj3 ASPARTYL/GLUTAMYL-TR
NA(ASN/GLN)
AMIDOTRANSFERASE
SUBUNIT B

(Pseudomonas
aeruginosa) 		PF02637
(GatB_Yqey)
PF02934
(GatB_N) 		5 VAL B 155
PRO B 158
ILE B 223
VAL B 170
ILE B 107
 None
 1.27A 4eb6B-4wj3B:
undetectable
4eb6C-4wj3B:
undetectable		 4eb6B-4wj3B:
19.93
4eb6C-4wj3B:
20.04
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.
4x6k ANHYDROSIALIDASE

([Ruminococcus]
gnavus) 		PF13088
(BNR_2) 		5 TYR A 471
PRO A 359
TYR A 337
ILE A 404
VAL A 417
 None
 1.29A 4eb6B-4x6kA:
undetectable
4eb6C-4x6kA:
undetectable		 4eb6B-4x6kA:
21.37
4eb6C-4x6kA:
24.27
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.
4xbr PROTEIN
FAM212A,SERINE/THREO
NINE-PROTEIN KINASE
PAK 4

(Homo sapiens) 		PF00069
(Pkinase)
PF15342
(FAM212) 		5 VAL A 509
THR A 408
ILE A 581
VAL A 420
ILE A 446
 None
 1.19A 4eb6B-4xbrA:
undetectable
4eb6C-4xbrA:
undetectable		 4eb6B-4xbrA:
22.15
4eb6C-4xbrA:
20.63
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.
4xfe TRAP DICARBOXYLATE
TRANSPORTER SUBUNIT
DCTP

(Pseudomonas
putida) 		PF03480
(DctP) 		5 VAL A 100
PRO A 237
ILE A 319
VAL A 108
ILE A 233
 None
 1.28A 4eb6B-4xfeA:
undetectable
4eb6C-4xfeA:
undetectable		 4eb6B-4xfeA:
20.73
4eb6C-4xfeA:
20.34
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.
4xru HEN1

(Capnocytophaga
gingivalis) 		no annotation 5 TYR C 181
THR C 178
ILE C  76
LYS C   1
ILE C 198
 None
 1.35A 4eb6B-4xruC:
undetectable
4eb6C-4xruC:
undetectable		 4eb6B-4xruC:
20.60
4eb6C-4xruC:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zem TRANSLATION
INITIATION FACTOR
EIF2B-LIKE
PROTEIN,TRANSLATION
INITIATION FACTOR
EIF2B-LIKE PROTEIN

(Chaetomium
thermophilum) 		PF01008
(IF-2B) 		5 VAL A 327
THR A 394
PRO A 392
ILE A 207
ILE A 213
 None
 1.28A 4eb6B-4zemA:
3.2
4eb6C-4zemA:
3.1		 4eb6B-4zemA:
22.98
4eb6C-4zemA:
21.46
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
GAMMA
METHYL-COENZYME M
REDUCTASE II,
SUBUNIT BETA

(Methanothermobacter
marburgensis) 		PF02240
(MCR_gamma)
PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 VAL B 293
THR C   8
PRO C   9
VAL B 272
ILE B 268
 None
 1.40A 4eb6B-5a8rB:
undetectable
4eb6C-5a8rB:
undetectable		 4eb6B-5a8rB:
21.10
4eb6C-5a8rB:
21.31
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.
5an9 60S ACIDIC RIBOSOMAL
PROTEIN P0

(Dictyostelium
discoideum) 		PF00466
(Ribosomal_L10) 		5 ASP C  66
THR C  79
TYR C 192
VAL C  63
ILE C  60
 None
None
None
None
A  N1456 ( 4.1A)
 1.29A 4eb6B-5an9C:
undetectable
4eb6C-5an9C:
undetectable		 4eb6B-5an9C:
20.23
4eb6C-5an9C:
18.44
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.
5cdh MAJOR ACID
PHOSPHATASE

(Legionella
pneumophila) 		PF00328
(His_Phos_2) 		5 VAL A  41
THR A  45
PRO A  44
PRO A 218
ILE A 226
 None
 1.37A 4eb6B-5cdhA:
undetectable
4eb6C-5cdhA:
undetectable		 4eb6B-5cdhA:
21.01
4eb6C-5cdhA:
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.
5cxc RIBOSOME BIOGENESIS
PROTEIN ERB1

(Chaetomium
thermophilum) 		PF00400
(WD40) 		5 VAL B 615
PRO B 628
PRO B 566
ILE B 585
VAL B 587
 None
 1.45A 4eb6B-5cxcB:
undetectable
4eb6C-5cxcB:
undetectable		 4eb6B-5cxcB:
22.29
4eb6C-5cxcB:
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.
5fmg PROTEASOME SUBUNIT
BETA TYPE

(Plasmodium
falciparum) 		PF00227
(Proteasome) 		5 VAL N  51
THR N  87
PRO N  88
ASN N  72
ILE N  73
 None
 1.35A 4eb6B-5fmgN:
undetectable
4eb6C-5fmgN:
undetectable		 4eb6B-5fmgN:
19.73
4eb6C-5fmgN:
17.71
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.
5hgz N-ALPHA-ACETYLTRANSF
ERASE 60

(Homo sapiens) 		PF00583
(Acetyltransf_1) 		5 VAL A  91
ILE A  77
LYS A  79
VAL A  95
ILE A  71
 None
 1.44A 4eb6B-5hgzA:
undetectable
4eb6C-5hgzA:
undetectable		 4eb6B-5hgzA:
17.97
4eb6C-5hgzA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5khl HEMIN ABC
TRANSPORTER,
PERIPLASMIC
HEMIN-BINDING
PROTEIN HUTB

(Vibrio cholerae) 		PF01497
(Peripla_BP_2) 		5 THR B  80
PRO B  79
ILE B 107
VAL B  32
ILE B  36
 None
 1.01A 4eb6B-5khlB:
undetectable
4eb6C-5khlB:
undetectable		 4eb6B-5khlB:
18.57
4eb6C-5khlB:
21.88
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.
5l56 PLEXIN-A1

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		5 VAL A 426
THR A 422
PRO A 423
TYR A 307
VAL A 435
 None
 1.37A 4eb6B-5l56A:
undetectable
4eb6C-5l56A:
undetectable		 4eb6B-5l56A:
16.68
4eb6C-5l56A:
15.57
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.
5lki TCDA1

(Photorhabdus
luminescens) 		PF03538
(VRP1) 		5 ASP A2456
PRO A2487
ILE A2415
VAL A2417
ILE A2507
 None
 1.29A 4eb6B-5lkiA:
undetectable
4eb6C-5lkiA:
undetectable		 4eb6B-5lkiA:
10.52
4eb6C-5lkiA:
10.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lq3 CMEB

(Campylobacter
jejuni) 		PF00873
(ACR_tran) 		5 VAL A 481
PRO A 375
ILE A  20
VAL A 487
ILE A 372
 None
 1.32A 4eb6B-5lq3A:
undetectable
4eb6C-5lq3A:
undetectable		 4eb6B-5lq3A:
19.55
4eb6C-5lq3A:
17.96
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.
5o2x GLYCOSIDE HYDROLASE
FAMILY 61

(Trichoderma
reesei) 		PF03443
(Glyco_hydro_61) 		5 VAL A 232
ASP A 115
ILE A 219
VAL A  91
ILE A 159
 None
 1.45A 4eb6B-5o2xA:
undetectable
4eb6C-5o2xA:
undetectable		 4eb6B-5o2xA:
20.22
4eb6C-5o2xA:
18.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ucy TUBULIN ALPHA CHAIN

(Tetrahymena
thermophila) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 PRO A 325
ASN A 329
ILE A 332
VAL A 353
ILE A 355
 None
 0.86A 4eb6B-5ucyA:
47.3
4eb6C-5ucyA:
52.2		 4eb6B-5ucyA:
40.96
4eb6C-5ucyA:
85.97
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.
5vbn DNA POLYMERASE
EPSILON SUBUNIT 2

(Homo sapiens) 		PF04042
(DNA_pol_E_B)
PF12213
(Dpoe2NT) 		5 THR A 317
PRO A 316
PRO A 514
ILE A 497
VAL A 519
 None
 1.42A 4eb6B-5vbnA:
undetectable
4eb6C-5vbnA:
undetectable		 4eb6B-5vbnA:
20.80
4eb6C-5vbnA:
20.84
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.
5vef SERINE/THREONINE-PRO
TEIN KINASE PAK 4

(Homo sapiens) 		no annotation 5 VAL A 509
THR A 408
ILE A 581
VAL A 420
ILE A 446
 None
 1.21A 4eb6B-5vefA:
undetectable
4eb6C-5vefA:
undetectable		 4eb6B-5vefA:
22.58
4eb6C-5vefA:
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.
5wy3 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		no annotation 5 VAL A 245
THR A 173
PRO A 124
VAL A 252
ILE A 127
 None
 1.42A 4eb6B-5wy3A:
undetectable
4eb6C-5wy3A:
undetectable		 4eb6B-5wy3A:
21.40
4eb6C-5wy3A:
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.
5xne -

(-) 		no annotation 5 VAL B  35
TYR B  36
PRO B  89
ILE B 247
ILE B 185
 None
 1.38A 4eb6B-5xneB:
undetectable
4eb6C-5xneB:
undetectable		 4eb6B-5xneB:
undetectable
4eb6C-5xneB:
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.
5xtd NADH DEHYDROGENASE
[UBIQUINONE] 1 ALPHA
SUBCOMPLEX SUBUNIT
9, MITOCHONDRIAL

(Homo sapiens) 		PF01370
(Epimerase) 		5 THR J  62
PRO J  83
ILE J 152
VAL J 126
ILE J  81
 NDP  J 401 (-3.0A)
None
None
None
None
 1.31A 4eb6B-5xtdJ:
undetectable
4eb6C-5xtdJ:
undetectable		 4eb6B-5xtdJ:
21.77
4eb6C-5xtdJ:
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.
5y58 ATP-DEPENDENT DNA
HELICASE II SUBUNIT
1
ATP-DEPENDENT DNA
HELICASE II SUBUNIT
2

(Saccharomyces
cerevisiae) 		no annotation 5 VAL A 352
PRO B 556
PRO B 559
ILE B 566
VAL B 529
 None
 1.44A 4eb6B-5y58A:
undetectable
4eb6C-5y58A:
undetectable		 4eb6B-5y58A:
11.70
4eb6C-5y58A:
12.13
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.
5y6q ALDEHYDE OXIDASE
SMALL SUBUNIT

(Methylobacillus
sp. KY4400) 		no annotation 5 VAL A  53
THR A 107
PRO A 108
ASN A 136
ILE A 150
 None
 1.45A 4eb6B-5y6qA:
undetectable
4eb6C-5y6qA:
undetectable		 4eb6B-5y6qA:
11.94
4eb6C-5y6qA:
11.76
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.
6dfu TRYPTOPHAN--TRNA
LIGASE

(Haemophilus
influenzae) 		no annotation 5 VAL A  10
THR A  78
TYR A  67
ILE A 136
VAL A 144
 None
 1.16A 4eb6B-6dfuA:
undetectable
4eb6C-6dfuA:
undetectable		 4eb6B-6dfuA:
10.99
4eb6C-6dfuA:
11.21
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.
6emk SERINE/THREONINE-PRO
TEIN KINASE TOR2

(Saccharomyces
cerevisiae) 		no annotation 5 VAL A1060
ASP A1053
ILE A1102
VAL A1086
ILE A1082
 None
 1.42A 4eb6B-6emkA:
undetectable
4eb6C-6emkA:
undetectable		 4eb6B-6emkA:
12.30
4eb6C-6emkA:
11.20
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.
6fn1 HUMAN-MOUSE CHIMERIC
ABCB1 (ABCBHM)

(Homo sapiens) 		no annotation 5 VAL A1034
THR A1064
ILE A1114
VAL A1079
ILE A1229
 None
 1.41A 4eb6B-6fn1A:
undetectable
4eb6C-6fn1A:
undetectable		 4eb6B-6fn1A:
11.49
4eb6C-6fn1A:
12.44
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.
6gru ADP-SUGAR
PYROPHOSPHATASE

(Homo sapiens) 		no annotation 5 THR A 117
PRO A  66
ILE A 123
VAL A 144
ILE A  65
 None
 1.18A 4eb6B-6gruA:
undetectable
4eb6C-6gruA:
undetectable		 4eb6B-6gruA:
11.60
4eb6C-6gruA:
10.50