SIMILAR PATTERNS OF AMINO ACIDS FOR 5YK2_A_ERYA501

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.
1bh6 SUBTILISIN DY

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		5 GLY A 229
ALA A 230
ALA A  85
PRO A  86
VAL A  28
 None
 1.16A 5yk2A-1bh6A:
0.0		 5yk2A-1bh6A:
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.
1c3l SUBTILISIN-CARLSBERG

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		5 GLY A 229
ALA A 230
ALA A  85
PRO A  86
VAL A  28
 None
 1.12A 5yk2A-1c3lA:
0.0		 5yk2A-1c3lA:
18.52
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.
1fu0 PHOSPHOCARRIER
PROTEIN HPR

(Enterococcus
faecalis) 		PF00381
(PTS-HPr) 		5 GLU A  84
GLY A  73
ALA A  76
ILE A  63
VAL A  65
 None
 1.16A 5yk2A-1fu0A:
undetectable		 5yk2A-1fu0A:
11.99
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.
1gns SUBTILISIN BPN'

(Bacillus
amyloliquefaciens) 		PF00082
(Peptidase_S8) 		5 GLY A 229
ALA A 230
ALA A  85
PRO A  86
VAL A  28
 None
 1.10A 5yk2A-1gnsA:
undetectable		 5yk2A-1gnsA:
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.
1hjq BETA-1,4-GALACTANASE

(Humicola
insolens) 		PF07745
(Glyco_hydro_53) 		5 GLU A  33
ASP A 128
ALA A  66
ILE A 125
VAL A 127
 None
 1.09A 5yk2A-1hjqA:
0.0		 5yk2A-1hjqA:
22.12
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.
1im4 DBH

(Sulfolobus
solfataricus) 		PF00817
(IMS)
PF11798
(IMS_HHH) 		5 GLU A 120
GLY A 144
ALA A 146
PRO A 147
ILE A 167
 None
 1.01A 5yk2A-1im4A:
0.2		 5yk2A-1im4A:
19.43
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.
1mu2 HIV-2 RT

(Human
immunodeficiency
virus 2) 		PF00075
(RNase_H)
PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb) 		5 GLU A 451
GLY A 455
ASP A 442
ALA A 454
VAL A 547
 None
 1.15A 5yk2A-1mu2A:
2.3		 5yk2A-1mu2A:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pox PYRUVATE OXIDASE

(Lactobacillus
plantarum) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A  62
ALA A  63
ALA A  65
ILE A 430
VAL A  56
 None
 1.10A 5yk2A-1poxA:
0.0		 5yk2A-1poxA:
23.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pv9 XAA-PRO DIPEPTIDASE

(Pyrococcus
furiosus) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		5 GLU A 260
ALA A 248
ALA A 252
ILE A 332
VAL A 330
 None
 1.05A 5yk2A-1pv9A:
0.0		 5yk2A-1pv9A:
24.24
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.
1t57 CONSERVED PROTEIN
MTH1675

(Methanothermobacter
thermautotrophicus) 		PF02887
(PK_C) 		5 GLU A  14
GLY A 152
ALA A 158
PRO A 184
VAL A 128
 None
FMN  A 200 ( 4.2A)
None
None
FMN  A 200 (-4.6A)
 1.18A 5yk2A-1t57A:
undetectable		 5yk2A-1t57A:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t5j HYPOTHETICAL PROTEIN
MJ1187

(Methanocaldococcus
jannaschii) 		PF03747
(ADP_ribosyl_GH) 		5 GLY A 162
ALA A 161
ALA A 165
ILE A 231
VAL A 227
 None
 1.02A 5yk2A-1t5jA:
1.5		 5yk2A-1t5jA:
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.
1t6k PHENAZINE
BIOSYNTHESIS PROTEIN
PHZF

(Pseudomonas
fluorescens) 		PF02567
(PhzC-PhzF) 		5 GLU A 235
GLY A 216
ALA A 215
ALA A 219
VAL A 262
 None
 1.16A 5yk2A-1t6kA:
undetectable		 5yk2A-1t6kA:
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.
1vhe AMINOPEPTIDASE/GLUCA
NASE HOMOLOG

(Bacillus
subtilis) 		PF05343
(Peptidase_M42) 		5 GLY A 186
ALA A 188
ALA A 190
ILE A  65
VAL A 236
 None
 1.21A 5yk2A-1vheA:
undetectable		 5yk2A-1vheA:
24.10
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.
1wpw 3-ISOPROPYLMALATE
DEHYDROGENASE

(Sulfurisphaera
tokodaii) 		PF00180
(Iso_dh) 		5 GLY A  43
ASP A  10
ALA A  42
ILE A   7
VAL A  73
 None
 1.22A 5yk2A-1wpwA:
undetectable		 5yk2A-1wpwA:
24.46
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.
1wu8 HYPOTHETICAL PROTEIN
PH0463

(Pyrococcus
horikoshii) 		PF01887
(SAM_adeno_trans) 		5 GLU A 146
GLU A 147
GLY A 136
ALA A 135
VAL A  62
 None
 1.14A 5yk2A-1wu8A:
undetectable		 5yk2A-1wu8A:
20.36
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.
1wuf HYPOTHETICAL PROTEIN
LIN2664

(Listeria
innocua) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLU A1310
GLY A1315
ALA A1306
ILE A1131
VAL A1133
 None
 1.09A 5yk2A-1wufA:
undetectable		 5yk2A-1wufA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b4q RHAMNOLIPIDS
BIOSYNTHESIS
3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Pseudomonas
aeruginosa) 		PF13561
(adh_short_C2) 		5 ARG A 194
GLY A 147
ALA A 191
PRO A 249
ILE A 152
 None
 1.08A 5yk2A-2b4qA:
undetectable		 5yk2A-2b4qA:
23.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c40 INOSINE-URIDINE
PREFERRING
NUCLEOSIDE HYDROLASE
FAMILY PROTEIN

(Bacillus
anthracis) 		PF01156
(IU_nuc_hydro) 		5 GLU A 171
GLY A  69
ASP A 177
ALA A  37
ILE A  35
 RIB  A1312 (-3.8A)
None
None
None
None
 1.18A 5yk2A-2c40A:
undetectable		 5yk2A-2c40A:
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.
2efl FORMIN-BINDING
PROTEIN 1

(Homo sapiens) 		PF00611
(FCH) 		5 GLU A 203
GLY A 120
ASP A 119
ALA A 123
PRO A 210
 None
 1.18A 5yk2A-2eflA:
0.7		 5yk2A-2eflA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f3o PYRUVATE
FORMATE-LYASE 2

(Archaeoglobus
fulgidus) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 GLU A 613
GLY A 628
ALA A 627
ALA A 542
ILE A 545
 None
 1.19A 5yk2A-2f3oA:
0.2		 5yk2A-2f3oA:
21.49
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.
2g2x HYPOTHETICAL PROTEIN
PP5205

(Pseudomonas
putida) 		PF01878
(EVE) 		5 GLU A 110
ARG A 107
GLY A  61
ALA A  60
ILE A 145
 None
 1.07A 5yk2A-2g2xA:
undetectable		 5yk2A-2g2xA:
16.96
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.
2h0a TRANSCRIPTIONAL
REGULATOR

(Thermus
thermophilus) 		PF13377
(Peripla_BP_3) 		5 GLU A 310
GLY A 301
ALA A 302
ILE A 124
VAL A 148
 None
 1.19A 5yk2A-2h0aA:
undetectable		 5yk2A-2h0aA:
22.47
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.
2iih MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
C

(Thermus
thermophilus) 		PF01967
(MoaC) 		5 GLY A  60
ALA A  59
ALA A 120
ILE A  97
VAL A  84
 None
 1.06A 5yk2A-2iihA:
undetectable		 5yk2A-2iihA:
17.04
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.
2o8e DNA MISMATCH REPAIR
PROTEIN MSH6

(Homo sapiens) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 GLY B1148
ALA B1147
ALA B1151
ILE B1170
VAL B1173
 None
 1.18A 5yk2A-2o8eB:
0.2		 5yk2A-2o8eB:
18.66
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.
2pw9 PUTATIVE FORMATE
DEHYDROGENASE
ACCESSORY PROTEIN

(Desulfotalea
psychrophila) 		PF02634
(FdhD-NarQ) 		5 GLU A  72
GLU A  73
GLY A 182
ALA A  59
ILE A 212
 None
 1.13A 5yk2A-2pw9A:
undetectable		 5yk2A-2pw9A:
21.74
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.
2qby CELL DIVISION
CONTROL PROTEIN 6
HOMOLOG 1

(Sulfolobus
solfataricus) 		PF09079
(Cdc6_C)
PF13401
(AAA_22) 		5 ARG A 363
GLY A 373
ALA A 358
ILE A 347
VAL A 306
 None
 1.15A 5yk2A-2qbyA:
undetectable		 5yk2A-2qbyA:
23.26
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.
2r9h H(+)/CL(-) EXCHANGE
TRANSPORTER CLCA

(Escherichia
coli) 		PF00654
(Voltage_CLC) 		5 GLU A 113
GLY A 181
ALA A 182
ALA A 179
ARG A 160
 None
 1.17A 5yk2A-2r9hA:
1.1		 5yk2A-2r9hA:
23.66
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.
2rb9 HYPE PROTEIN

(Escherichia
coli) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLU A  49
ARG A  92
ALA A  85
ILE A 157
ARG A 211
 None
 1.17A 5yk2A-2rb9A:
undetectable		 5yk2A-2rb9A:
23.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v2t TRANSCRIPTION FACTOR
RELB

(Mus musculus) 		PF00554
(RHD_DNA_bind)
PF16179
(RHD_dimer) 		5 GLU A 121
GLY A 184
ASP A 183
PRO A 173
ARG A 219
 None
 1.13A 5yk2A-2v2tA:
undetectable		 5yk2A-2v2tA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wua ACETOACETYL COA
THIOLASE

(Helianthus
annuus) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLY A 162
ALA A 398
ALA A 298
ILE A 159
VAL A 100
 None
 1.17A 5yk2A-2wuaA:
undetectable		 5yk2A-2wuaA:
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.
2zbt PYRIDOXAL
BIOSYNTHESIS LYASE
PDXS

(Thermus
thermophilus) 		PF01680
(SOR_SNZ) 		5 GLU A  39
ALA A  42
ALA A 251
ILE A 241
VAL A 237
 None
None
None
None
MPD  A 903 (-4.9A)
 1.05A 5yk2A-2zbtA:
undetectable		 5yk2A-2zbtA:
24.36
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.
2zsg AMINOPEPTIDASE P,
PUTATIVE

(Thermotoga
maritima) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		5 GLU A 322
ALA A 257
ALA A 253
ILE A 278
ARG A 275
 ZN  A1001 (-2.8A)
None
None
None
CL  A1005 (-4.4A)
 1.21A 5yk2A-2zsgA:
undetectable		 5yk2A-2zsgA:
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.
3awd PUTATIVE POLYOL
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF13561
(adh_short_C2) 		5 GLY A 146
ALA A 191
ALA A 189
ILE A 173
VAL A 169
 None
 0.98A 5yk2A-3awdA:
undetectable		 5yk2A-3awdA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dkw DNR PROTEIN

(Pseudomonas
aeruginosa) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		5 ALA A 185
PRO A 192
ILE A 190
ARG A 156
VAL A 157
 None
 1.12A 5yk2A-3dkwA:
undetectable		 5yk2A-3dkwA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dms ISOCITRATE
DEHYDROGENASE [NADP]

(Burkholderia
pseudomallei) 		PF00180
(Iso_dh) 		5 GLY A 247
ALA A 249
ALA A 251
ILE A 216
VAL A 212
 None
 1.02A 5yk2A-3dmsA:
undetectable		 5yk2A-3dmsA:
23.64
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.
3g85 TRANSCRIPTIONAL
REGULATOR (LACI
FAMILY)

(Clostridium
acetobutylicum) 		PF13377
(Peripla_BP_3) 		5 GLU A 301
ARG A  86
GLY A 278
PRO A 329
ILE A 331
 None
 1.10A 5yk2A-3g85A:
undetectable		 5yk2A-3g85A:
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.
3gkb PUTATIVE ENOYL-COA
HYDRATASE

(Streptomyces
avermitilis) 		PF00378
(ECH_1) 		5 GLU A  14
ALA A 208
ALA A 204
ILE A 108
VAL A 106
 None
 1.17A 5yk2A-3gkbA:
undetectable		 5yk2A-3gkbA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hc1 UNCHARACTERIZED HDOD
DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF08668
(HDOD) 		5 GLU A 134
GLY A 124
ALA A 126
ILE A 294
VAL A 298
 GOL  A 311 (-3.5A)
None
None
None
None
 1.21A 5yk2A-3hc1A:
1.2		 5yk2A-3hc1A:
24.89
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.
3jd5 28S RIBOSOMAL
PROTEIN S23,
MITOCHONDRIAL

(Bos taurus) 		PF00318
(Ribosomal_S2) 		5 GLU b 101
GLU b 105
GLY b 122
ALA b 121
ALA b 124
 None
 1.19A 5yk2A-3jd5b:
undetectable		 5yk2A-3jd5b:
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.
3l49 ABC SUGAR (RIBOSE)
TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
SUBUNIT

(Rhodobacter
sphaeroides) 		PF13407
(Peripla_BP_4) 		5 GLU A  58
ARG A  59
GLY A 278
ALA A  52
ILE A  92
 None
 1.15A 5yk2A-3l49A:
undetectable		 5yk2A-3l49A:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mkb HEMOGLOBIN SUBUNIT
ALPHA

(Isurus
oxyrinchus) 		PF00042
(Globin) 		5 GLY A  59
ALA A  26
ALA A  28
ILE A 105
VAL A  62
 None
None
None
None
HEM  A 141 (-3.8A)
 1.22A 5yk2A-3mkbA:
2.3		 5yk2A-3mkbA:
15.49
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.
3n05 NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Streptomyces
avermitilis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		5 ARG A 376
GLY A 333
ASP A 370
ALA A 338
ILE A 483
 None
 1.22A 5yk2A-3n05A:
undetectable		 5yk2A-3n05A:
22.58
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.
3nix FLAVOPROTEIN/DEHYDRO
GENASE

(Cytophaga
hutchinsonii) 		PF01494
(FAD_binding_3) 		5 GLU A 313
GLY A  17
ALA A  16
ALA A  20
VAL A  10
 None
None
FAD  A 501 (-3.2A)
None
None
 1.04A 5yk2A-3nixA:
0.8		 5yk2A-3nixA:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nut PRECORRIN-3
METHYLASE

(Rhodobacter
capsulatus) 		PF00590
(TP_methylase) 		5 GLY A  84
ASP A  82
ALA A  87
ALA A  89
ILE A 109
 None
None
SAH  A1501 (-3.5A)
None
GOL  A 246 (-4.5A)
 0.92A 5yk2A-3nutA:
undetectable		 5yk2A-3nutA:
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.
3pl2 SUGAR KINASE,
RIBOKINASE FAMILY

(Corynebacterium
glutamicum) 		PF00294
(PfkB) 		5 ARG A 297
GLY A 259
ALA A 295
PRO A 103
ILE A 101
 None
 1.07A 5yk2A-3pl2A:
undetectable		 5yk2A-3pl2A:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qhy BETA-LACTAMASE

(Bacillus
anthracis) 		PF13354
(Beta-lactamase2) 		5 ARG A 244
GLY A 224
ALA A 280
ALA A 283
ILE A 261
 None
 1.11A 5yk2A-3qhyA:
undetectable		 5yk2A-3qhyA:
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.
3qz5 CO-TYPE NITRILE
HYDRATASE ALPHA
SUBUNIT

(Pseudomonas
putida) 		PF02979
(NHase_alpha) 		5 ARG A 138
GLY A  13
ASP A  12
ALA A 132
PRO A 127
 None
GOL  A 212 ( 3.9A)
None
GOL  A 212 ( 3.8A)
None
 1.08A 5yk2A-3qz5A:
undetectable		 5yk2A-3qz5A:
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.
3qz5 CO-TYPE NITRILE
HYDRATASE ALPHA
SUBUNIT

(Pseudomonas
putida) 		PF02979
(NHase_alpha) 		5 GLY A  13
ASP A  12
ALA A 132
ALA A 128
PRO A 127
 GOL  A 212 ( 3.9A)
None
GOL  A 212 ( 3.8A)
None
None
 1.15A 5yk2A-3qz5A:
undetectable		 5yk2A-3qz5A:
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.
3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE

(Klebsiella
pneumoniae) 		PF05035
(DGOK) 		5 GLY A 275
ASP A 276
ALA A 274
ALA A 251
PRO A 138
 None
 1.16A 5yk2A-3r1xA:
undetectable		 5yk2A-3r1xA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sgi DNA LIGASE

(Mycobacterium
tuberculosis) 		PF01653
(DNA_ligase_aden)
PF03120
(DNA_ligase_OB) 		5 ALA A 351
ALA A 366
PRO A 395
ILE A 387
VAL A 385
 None
 1.02A 5yk2A-3sgiA:
2.4		 5yk2A-3sgiA:
24.61
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.
3uif SULFONATE ABC
TRANSPORTER,
PERIPLASMIC
SULFONATE-BINDING
PROTEIN SSUA

(Methylobacillus
flagellatus) 		PF09084
(NMT1) 		5 GLU A  69
GLY A  94
ALA A  33
ILE A 243
VAL A 226
 None
 1.16A 5yk2A-3uifA:
0.9		 5yk2A-3uifA:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vpr TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY

(Thermus
thermophilus) 		PF00440
(TetR_N) 		5 GLU A  84
GLY A  66
ALA A  65
ALA A  69
ILE A 129
 None
 1.04A 5yk2A-3vprA:
2.2		 5yk2A-3vprA:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3x2z UPF0173
METAL-DEPENDENT
HYDROLASE TM_1162

(Thermotoga
maritima) 		PF12706
(Lactamase_B_2) 		5 GLU A 202
GLY A 164
ASP A 170
ALA A 199
PRO A 188
 None
 1.19A 5yk2A-3x2zA:
undetectable		 5yk2A-3x2zA:
18.64
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.
4a3s 6-PHOSPHOFRUCTOKINAS
E

(Bacillus
subtilis) 		PF00365
(PFK) 		5 GLY A 268
ALA A  22
ALA A 264
ILE A 137
VAL A 122
 None
 1.03A 5yk2A-4a3sA:
undetectable		 5yk2A-4a3sA:
23.43
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.
4aq1 SBSB PROTEIN

(Geobacillus
stearothermophilus) 		no annotation 5 ARG C 451
ALA C 460
ALA C 458
ILE C 457
VAL C 495
 None
 1.20A 5yk2A-4aq1C:
undetectable		 5yk2A-4aq1C:
20.11
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.
4f4w DNA POLYMERASE IV

(Sulfolobus
acidocaldarius;
Sulfolobus
solfataricus) 		PF00817
(IMS)
PF11798
(IMS_HHH) 		5 GLU A 120
GLY A 144
ALA A 146
PRO A 147
ILE A 167
 None
 1.12A 5yk2A-4f4wA:
2.0		 5yk2A-4f4wA:
22.39
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.
4fuk METHIONINE
AMINOPEPTIDASE

(Trypanosoma
brucei) 		PF00557
(Peptidase_M24) 		5 GLU A 156
ALA A 144
ALA A 148
ILE A 229
VAL A 227
 None
 1.17A 5yk2A-4fukA:
undetectable		 5yk2A-4fukA:
21.29
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.
4g92 TRANSCRIPTION FACTOR
HAPC (EUROFUNG)
HAPE

(Aspergillus
nidulans;
Aspergillus
nidulans) 		PF00808
(CBFD_NFYB_HMF)
PF00808
(CBFD_NFYB_HMF) 		5 GLY B 104
ASP B 106
ALA C 109
PRO C 110
ILE C 105
 None
 1.19A 5yk2A-4g92B:
undetectable		 5yk2A-4g92B:
12.67
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.
4iqg SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Polaromonas sp.
JS666) 		no annotation 5 ARG C  48
ALA C  23
ALA C  19
ILE C   7
VAL C   5
 None
 1.18A 5yk2A-4iqgC:
undetectable		 5yk2A-4iqgC:
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.
4j9v POTASSIUM UPTAKE
PROTEIN TRKA

(Vibrio
parahaemolyticus) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		5 GLU A 429
GLY A 400
ASP A 424
ALA A 398
ILE A 410
 None
 1.07A 5yk2A-4j9vA:
undetectable		 5yk2A-4j9vA:
24.19
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.
4ldp NDP-FOROSAMYLTRANSFE
RASE

(Saccharopolyspora
spinosa) 		PF06722
(DUF1205) 		5 GLU A 290
GLY A 283
ALA A 285
ILE A 329
VAL A 383
 None
 1.05A 5yk2A-4ldpA:
undetectable		 5yk2A-4ldpA:
23.89
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.
4lry PTS-DEPENDENT
DIHYDROXYACETONE
KINASE OPERON
REGULATORY PROTEIN

(Escherichia
coli) 		PF00989
(PAS) 		5 GLU C  66
GLY C  57
ALA C  59
ILE C 181
VAL C 185
 None
 1.12A 5yk2A-4lryC:
undetectable		 5yk2A-4lryC:
22.94
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.
4mnr PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE

(Eggerthella
lenta) 		PF00905
(Transpeptidase) 		5 GLU A 298
GLY A 246
ALA A 295
ALA A 292
ILE A 212
 None
 0.99A 5yk2A-4mnrA:
undetectable		 5yk2A-4mnrA:
23.17
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.
4mzd NISIN LEADER
PEPTIDE-PROCESSING
SERINE PROTEASE NISP

(Lactococcus
lactis) 		PF00082
(Peptidase_S8) 		5 GLY A 520
ALA A 521
ALA A 324
PRO A 325
VAL A 255
 None
 1.01A 5yk2A-4mzdA:
0.2		 5yk2A-4mzdA:
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.
4ozu CORONIN

(Toxoplasma
gondii) 		PF00400
(WD40)
PF08953
(DUF1899)
PF16300
(WD40_4) 		5 GLU A  42
GLY A 113
ALA A  71
ALA A  69
PRO A  68
 None
 1.14A 5yk2A-4ozuA:
undetectable		 5yk2A-4ozuA:
23.63
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.
4q8r PHOSPHATE ABC
TRANSPORTER,
PHOSPHATE-BINDING
PROTEIN

(Clostridium
perfringens) 		PF12849
(PBP_like_2) 		5 GLU A  75
GLY A 130
ASP A 133
ALA A  58
ILE A  45
 None
PO4  A 301 (-3.5A)
None
None
None
 1.20A 5yk2A-4q8rA:
undetectable		 5yk2A-4q8rA:
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.
4s05 DNA-BINDING
TRANSCRIPTIONAL
REGULATOR BASR

(Klebsiella
pneumoniae) 		PF00072
(Response_reg)
PF00486
(Trans_reg_C) 		5 ARG A 111
GLY A  90
ALA A  95
ILE A  88
ARG A  87
 None
 1.20A 5yk2A-4s05A:
undetectable		 5yk2A-4s05A:
19.96
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.
4uyp CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B

(Acetivibrio
cellulolyticus) 		no annotation 5 GLU B  35
GLY B   5
ASP B  17
ALA B  40
VAL B  13
 EPE  B1076 (-4.2A)
None
CA  B 201 (-2.2A)
None
None
 1.10A 5yk2A-4uypB:
undetectable		 5yk2A-4uypB:
9.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xr9 CALS8

(Micromonospora
echinospora) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 GLU A 194
ARG A 195
GLY A 158
ALA A 160
ILE A 128
 None
 1.21A 5yk2A-4xr9A:
undetectable		 5yk2A-4xr9A:
23.67
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.
4z64 PHYTOSULFOKINE
RECEPTOR 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 GLU A  94
ASP A  35
ALA A  38
ILE A 102
VAL A  78
 None
 1.02A 5yk2A-4z64A:
undetectable		 5yk2A-4z64A:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zhj MG-CHELATASE SUBUNIT
CHLH

(Synechocystis
sp. PCC 6803) 		PF02514
(CobN-Mg_chel)
PF11965
(DUF3479) 		5 GLU A 845
ALA A 838
ALA A 840
ILE A 779
VAL A 783
 None
 0.97A 5yk2A-4zhjA:
3.2		 5yk2A-4zhjA:
16.62
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.
4zve DIGUANYLATE CYCLASE
DOSC

(Escherichia
coli) 		PF00990
(GGDEF) 		5 GLY A 421
ALA A 422
ALA A 441
ILE A 444
ARG A 452
 None
None
None
None
EDO  A 502 ( 3.9A)
 1.08A 5yk2A-4zveA:
undetectable		 5yk2A-4zveA:
17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5btb AFR263CP

(Eremothecium
gossypii) 		PF08652
(RAI1) 		5 GLU A 286
GLY A 218
ASP A 217
ILE A 267
VAL A 216
 None
 1.08A 5yk2A-5btbA:
undetectable		 5yk2A-5btbA:
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.
5cee NAD-DEPENDENT MALIC
ENZYME

(Aster yellows
witches'-broom
phytoplasma) 		PF00390
(malic)
PF03949
(Malic_M) 		5 GLY A 326
ASP A 329
ALA A 375
PRO A 321
ILE A 101
 None
 1.07A 5yk2A-5ceeA:
undetectable		 5yk2A-5ceeA:
21.37
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.
5f7s GLYCOSIDE HYDROLASE
FAMILY 31

(Trueperella
pyogenes) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		5 GLY A 521
ALA A 284
ALA A 524
ARG A 498
VAL A 494
 None
 1.16A 5yk2A-5f7sA:
undetectable		 5yk2A-5f7sA:
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.
5fl7 ATP SYNTHASE SUBUNIT
ALPHA

(Yarrowia
lipolytica) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		5 ARG A 152
GLY A 276
ALA A 278
ILE A 256
VAL A 258
 None
 1.11A 5yk2A-5fl7A:
undetectable		 5yk2A-5fl7A:
26.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ghs SSDNA-SPECIFIC
EXONUCLEASE

(Thermococcus
kodakarensis) 		PF02272
(DHHA1) 		5 GLY A 162
ASP A  36
ALA A 163
ALA A 159
ILE A  43
 None
 1.18A 5yk2A-5ghsA:
undetectable		 5yk2A-5ghsA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
CIRCADIAN CLOCK
PROTEIN KAIB

(Thermosynechococcus
elongatus;
Thermosynechococcus
elongatus) 		PF06745
(ATPase)
PF07689
(KaiB) 		5 GLU B  84
ARG B  83
GLY A 120
ASP B  79
ALA A 119
 None
 1.15A 5yk2A-5jwrB:
undetectable		 5yk2A-5jwrB:
13.20
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.
5lq3 CMEB

(Campylobacter
jejuni) 		PF00873
(ACR_tran) 		5 GLY A 485
ASP A 410
ALA A 488
ILE A 446
VAL A 449
 None
 0.98A 5yk2A-5lq3A:
undetectable		 5yk2A-5lq3A:
18.18
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.
5lxv CARBOHYDRATE-BINDING
PROTEIN WP_009985128

(Ruminococcus
flavefaciens) 		no annotation 5 GLY B 891
ASP B 892
ALA B 921
PRO B 950
VAL B 899
 None
CA  B1001 (-3.2A)
None
None
None
 1.07A 5yk2A-5lxvB:
undetectable		 5yk2A-5lxvB:
11.99
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.
5mzo UDP-GLUCOSE-GLYCOPRO
TEIN
GLUCOSYLTRANSFERASE-
LIKE PROTEIN

(Chaetomium
thermophilum) 		PF06427
(UDP-g_GGTase) 		5 GLU A1371
GLY A1375
ASP A1376
ALA A1374
ILE A1073
 None
 1.09A 5yk2A-5mzoA:
1.4		 5yk2A-5mzoA:
16.49
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.
5tf2 PROLACTIN REGULATORY
ELEMENT-BINDING
PROTEIN

(Homo sapiens) 		PF00400
(WD40) 		5 GLU A 354
GLU A 366
GLY A 316
ASP A 307
VAL A 349
 None
 1.05A 5yk2A-5tf2A:
undetectable		 5yk2A-5tf2A:
22.69
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.
5u89 AMINO ACID
ADENYLATION DOMAIN
PROTEIN

(Geobacillus sp.
Y4.1MC1) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF13193
(AMP-binding_C) 		5 GLU A1360
ARG A1359
GLY A1307
ALA A1306
ILE A1492
 None
 1.17A 5yk2A-5u89A:
undetectable		 5yk2A-5u89A:
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.
5ub6 PHOSPHATE-BINDING
PROTEIN

(Xanthomonas
citri) 		no annotation 5 ARG A 240
ALA A  98
ILE A  39
ARG A  38
VAL A  92
 None
 1.10A 5yk2A-5ub6A:
undetectable		 5yk2A-5ub6A:
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.
5uth THIOREDOXIN
REDUCTASE

(Mycolicibacterium
smegmatis) 		PF07992
(Pyr_redox_2) 		5 GLU A 304
GLY A 296
ALA A 298
ALA A  22
ILE A  12
 None
 1.14A 5yk2A-5uthA:
undetectable		 5yk2A-5uthA:
22.58
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.
5utk ANGIOPOIETIN-1
RECEPTOR

(Homo sapiens) 		PF00041
(fn3) 		5 GLU A 643
GLY A 664
ASP A 663
PRO A 639
ILE A 667
 None
 1.22A 5yk2A-5utkA:
undetectable		 5yk2A-5utkA:
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.
5x4j UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		no annotation 5 GLY A 161
ASP A  36
ALA A 162
ALA A 158
ILE A  43
 None
ZN  A 501 (-3.1A)
None
None
None
 1.16A 5yk2A-5x4jA:
undetectable		 5yk2A-5x4jA:
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.
5xa2 CYSTEINE SYNTHASE

(Planctopirus
limnophila) 		PF00291
(PALP) 		5 GLU A   9
GLY A  48
ALA A  50
ILE A 152
ARG A  46
 None
LLP  A  44 ( 3.7A)
None
None
None
 0.90A 5yk2A-5xa2A:
undetectable		 5yk2A-5xa2A:
23.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xgj PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT ALPHA
ISOFORM

(Homo sapiens) 		no annotation 5 GLU A 982
ARG A 979
GLY A 903
ALA A 902
ALA A 987
 None
 1.16A 5yk2A-5xgjA:
5.9		 5yk2A-5xgjA:
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.
5xvs GDP/UDP-N,N'-DIACETY
LBACILLOSAMINE
2-EPIMERASE
(HYDROLYZING)

(Acinetobacter
baumannii) 		no annotation 5 GLU A  64
GLY A   9
ALA A  38
ALA A  36
ILE A  52
 None
 1.04A 5yk2A-5xvsA:
undetectable		 5yk2A-5xvsA:
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.
5xww AMPHB

(Streptomyces
nodosus) 		no annotation 5 GLU A 267
ARG A 272
GLY A 242
ALA A 239
VAL A 217
 None
 1.10A 5yk2A-5xwwA:
undetectable		 5yk2A-5xwwA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xya -

(-) 		no annotation 5 GLY A 625
ALA A 626
ALA A 305
PRO A 306
VAL A 147
 None
 1.06A 5yk2A-5xyaA:
undetectable		 5yk2A-5xyaA:
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.
5yk2 PROBABLE CONSERVED
ATP-BINDING PROTEIN
ABC TRANSPORTER

(Mycobacterium
tuberculosis) 		no annotation 11 GLU A 196
GLU A 199
ARG A 200
GLY A 285
ASP A 286
ALA A 307
ALA A 309
PRO A 310
ILE A 407
ARG A 410
VAL A 411
 ERY  A 501 (-2.9A)
ERY  A 501 ( 4.0A)
None
ERY  A 501 ( 3.7A)
ERY  A 501 (-4.2A)
ERY  A 501 (-3.8A)
ERY  A 501 (-3.3A)
ERY  A 501 ( 4.7A)
ERY  A 501 (-4.1A)
ERY  A 501 (-4.1A)
None
 0.06A 5yk2A-5yk2A:
57.7		 5yk2A-5yk2A:
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.
5z5d BETA-XYLOSIDASE

(Geobacillus
thermoleovorans) 		no annotation 5 GLU A 403
GLY A 350
ALA A 489
PRO A 361
VAL A 495
 None
 1.15A 5yk2A-5z5dA:
undetectable		 5yk2A-5z5dA:
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.
6ck0 BIOTIN ACETYL
COENZYME A
CARBOXYLASE
SYNTHETASE

(Helicobacter
pylori) 		no annotation 5 GLY A 200
ASP A 199
ALA A  76
PRO A 101
ILE A 202
 None
None
None
F5D  A 301 ( 4.8A)
None
 1.19A 5yk2A-6ck0A:
undetectable		 5yk2A-6ck0A:
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.
6cxd PEPTIDASE B

(Yersinia pestis) 		no annotation 5 GLU A 100
GLY A 228
ALA A 231
ALA A 229
VAL A 111
 SO4  A 501 (-4.2A)
None
None
None
None
 1.21A 5yk2A-6cxdA:
undetectable		 5yk2A-6cxdA:
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.
6d0n CLC-TYPE
FLUORIDE/PROTON
ANTIPORTER

(Enterococcus
casseliflavus) 		no annotation 5 GLY A  29
ASP A  32
ALA A 192
ILE A 128
VAL A  31
 None
 1.18A 5yk2A-6d0nA:
0.7		 5yk2A-6d0nA:
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.
6en4 SPLICING FACTOR 3B
SUBUNIT 3
SPLICING FACTOR 3B
SUBUNIT 5

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		5 GLU B  59
ASP A 803
ALA A 806
ALA A 854
ARG A 429
 None
 1.14A 5yk2A-6en4B:
undetectable		 5yk2A-6en4B:
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 5 GLY A 259
ALA A 260
ALA A 108
PRO A 109
VAL A  45
 None
 0.98A 5yk2A-6f9mA:
undetectable		 5yk2A-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.
6g2j NADH DEHYDROGENASE
[UBIQUINONE]
FLAVOPROTEIN 1,
MITOCHONDRIAL

(Mus musculus) 		no annotation 5 GLU F 189
ASP F  98
ALA F 191
PRO F 203
ILE F 185
 FMN  F 501 ( 4.8A)
FMN  F 501 (-3.9A)
None
SF4  F 502 (-4.0A)
SF4  F 502 ( 4.2A)
 1.17A 5yk2A-6g2jF:
undetectable		 5yk2A-6g2jF:
undetectable