SIMILAR PATTERNS OF AMINO ACIDS FOR 5IM2_A_BEZA401

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.
1b41 ACETYLCHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		6 PHE A 321
ILE A 316
PRO A 232
LEU A 213
LEU A 227
VAL A 326
 None
 1.43A 5im2A-1b41A:
undetectable		 5im2A-1b41A:
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.
1hn0 CHONDROITIN ABC
LYASE I

(Proteus
vulgaris) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		5 ILE A 213
LEU A 115
LEU A 125
VAL A 145
PHE A 111
 None
 1.19A 5im2A-1hn0A:
0.0		 5im2A-1hn0A:
17.57
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.
1j5t INDOLE-3-GLYCEROL
PHOSPHATE SYNTHASE

(Thermotoga
maritima) 		PF00218
(IGPS) 		5 PHE A 146
VAL A 134
LEU A 142
LEU A 174
VAL A 136
 None
 1.17A 5im2A-1j5tA:
undetectable		 5im2A-1j5tA:
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.
1kkr 3-METHYLASPARTATE
AMMONIA-LYASE

(Citrobacter
amalonaticus) 		PF05034
(MAAL_N)
PF07476
(MAAL_C) 		5 PHE A  92
ILE A 121
LEU A  93
LEU A 134
VAL A 130
 None
 1.14A 5im2A-1kkrA:
0.0		 5im2A-1kkrA:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lcy HTRA2 SERINE
PROTEASE

(Homo sapiens) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 VAL A 184
ILE A  96
LEU A 209
LEU A  59
VAL A  54
 None
 1.17A 5im2A-1lcyA:
undetectable		 5im2A-1lcyA:
22.19
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.
1n8y PROTOONCOPROTEIN

(Rattus
norvegicus) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		5 VAL C 132
TRP C 148
LEU C 119
LEU C 116
VAL C  94
 None
 1.23A 5im2A-1n8yC:
undetectable		 5im2A-1n8yC:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ow1 SMART/HDAC1
ASSOCIATED REPRESSOR
PROTEIN

(Homo sapiens) 		PF07744
(SPOC) 		5 PHE A3599
PRO A3546
LEU A3513
VAL A3522
GLN A3591
 None
 1.10A 5im2A-1ow1A:
undetectable		 5im2A-1ow1A:
18.59
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.
1qqg INSULIN RECEPTOR
SUBSTRATE 1

(Homo sapiens) 		PF00169
(PH)
PF02174
(IRS) 		5 PHE A 221
MET A 238
VAL A 166
ILE A 253
LEU A 206
 None
 1.23A 5im2A-1qqgA:
undetectable		 5im2A-1qqgA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tll NITRIC-OXIDE
SYNTHASE, BRAIN

(Rattus
norvegicus) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		5 PHE A 821
VAL A 802
ILE A 793
LEU A 825
LEU A 906
 None
 1.11A 5im2A-1tllA:
0.0		 5im2A-1tllA:
19.80
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.
1w1w STRUCTURAL
MAINTENANCE OF
CHROMOSOME 1

(Saccharomyces
cerevisiae) 		PF02463
(SMC_N) 		5 PHE A1143
VAL A 149
ILE A1175
LEU A1139
LEU A1163
 None
 1.27A 5im2A-1w1wA:
undetectable		 5im2A-1w1wA:
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.
1w36 EXODEOXYRIBONUCLEASE
V GAMMA CHAIN

(Escherichia
coli) 		PF04257
(Exonuc_V_gamma) 		5 VAL C 659
LEU C 389
LEU C 678
VAL C 410
PHE C 426
 None
 1.13A 5im2A-1w36C:
undetectable		 5im2A-1w36C:
16.34
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.
1wyt GLYCINE
DEHYDROGENASE
(DECARBOXYLATING)
SUBUNIT 1
GLYCINE
DEHYDROGENASE
SUBUNIT 2
(P-PROTEIN)

(Thermus
thermophilus;
Thermus
thermophilus) 		PF02347
(GDC-P)
PF02347
(GDC-P) 		5 MET A 332
VAL A  82
PRO B 277
LEU A 328
GLN A  83
 None
 1.23A 5im2A-1wytA:
undetectable		 5im2A-1wytA:
23.38
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.
1xks NUCLEAR PORE COMPLEX
PROTEIN NUP133

(Homo sapiens) 		no annotation 5 VAL A 156
ILE A 124
LEU A 142
LEU A 190
VAL A 175
 None
 1.18A 5im2A-1xksA:
undetectable		 5im2A-1xksA:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yhn RAS-RELATED PROTEIN
RAB-7

(Homo sapiens) 		PF00071
(Ras) 		5 PHE A 166
VAL A 121
ILE A  61
LEU A  24
VAL A  87
 None
 1.23A 5im2A-1yhnA:
undetectable		 5im2A-1yhnA:
19.74
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.
1yrg GTPASE-ACTIVATING
PROTEIN RNA1_SCHPO

(Schizosaccharomyces
pombe) 		no annotation 5 VAL A 321
ILE A 286
LEU A 294
LEU A 308
PHE A 315
 None
 1.24A 5im2A-1yrgA:
undetectable		 5im2A-1yrgA:
22.35
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.
1yxa SERINE (OR CYSTEINE)
PROTEINASE
INHIBITOR, CLADE A,
MEMBER 3N

(Mus musculus) 		PF00079
(Serpin) 		5 MET A 203
ILE A 147
LEU A 139
LEU A  84
VAL A  85
 None
 1.22A 5im2A-1yxaA:
undetectable		 5im2A-1yxaA:
23.09
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.
2ajr SUGAR KINASE, PFKB
FAMILY

(Thermotoga
maritima) 		PF00294
(PfkB) 		5 VAL A 138
ILE A 179
LEU A 156
LEU A   7
VAL A   5
 None
 1.13A 5im2A-2ajrA:
1.6		 5im2A-2ajrA:
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.
2bx7 DIHYDROOROTATE
DEHYDROGENASE

(Lactococcus
lactis) 		PF01180
(DHO_dh) 		5 PHE A 184
ILE A 180
LEU A 150
LEU A 128
VAL A 163
 None
 1.26A 5im2A-2bx7A:
undetectable		 5im2A-2bx7A:
22.78
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.
2cc0 ACETYL-XYLAN
ESTERASE

(Streptomyces
lividans) 		PF01522
(Polysacc_deac_1) 		6 PHE A  11
MET A 154
ILE A 165
LEU A   9
LEU A 172
VAL A 143
 None
 1.28A 5im2A-2cc0A:
undetectable		 5im2A-2cc0A:
18.16
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.
2col BIFUNCTIONAL
HEMOLYSIN-ADENYLATE
CYCLASE

(Bordetella
pertussis) 		PF03497
(Anthrax_toxA) 		5 PHE A  40
MET A 191
VAL A 296
LEU A  38
VAL A 279
 None
None
MG  A 908 (-3.3A)
None
None
 1.14A 5im2A-2colA:
undetectable		 5im2A-2colA:
22.66
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.
2e4u METABOTROPIC
GLUTAMATE RECEPTOR 3

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		5 MET A 276
VAL A 247
ILE A 285
LEU A 274
VAL A 216
 None
 1.19A 5im2A-2e4uA:
undetectable		 5im2A-2e4uA:
19.33
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.
2gnp TRANSCRIPTIONAL
REGULATOR

(Streptococcus
pneumoniae) 		PF04198
(Sugar-bind) 		5 PHE A 138
ILE A 107
LEU A 124
VAL A 125
PHE A 165
 None
 1.17A 5im2A-2gnpA:
undetectable		 5im2A-2gnpA:
23.22
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.
2gp4 6-PHOSPHOGLUCONATE
DEHYDRATASE

(Shewanella
oneidensis) 		PF00920
(ILVD_EDD) 		5 VAL A 281
PRO A 177
LEU A 174
LEU A 241
VAL A 373
 None
 1.18A 5im2A-2gp4A:
undetectable		 5im2A-2gp4A:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gq0 CHAPERONE PROTEIN
HTPG

(Escherichia
coli) 		PF00183
(HSP90) 		5 PHE A 320
ILE A 280
LEU A 318
LEU A 357
PHE A 374
 None
 1.24A 5im2A-2gq0A:
undetectable		 5im2A-2gq0A:
21.36
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.
2iop CHAPERONE PROTEIN
HTPG

(Escherichia
coli) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		5 PHE A 320
ILE A 280
LEU A 318
LEU A 357
PHE A 374
 None
 1.24A 5im2A-2iopA:
undetectable		 5im2A-2iopA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iuu DNA TRANSLOCASE FTSK

(Pseudomonas
aeruginosa) 		PF01580
(FtsK_SpoIIIE) 		5 VAL A 591
ILE A 510
LEU A 480
LEU A 504
VAL A 593
 None
 1.27A 5im2A-2iuuA:
undetectable		 5im2A-2iuuA:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ivf ETHYLBENZENE
DEHYDROGENASE
GAMMA-SUBUNIT

(Aromatoleum
aromaticum) 		PF09459
(EB_dh) 		5 PHE C 210
MET C   1
ILE C  69
LEU C  73
VAL C  60
 None
 1.27A 5im2A-2ivfC:
undetectable		 5im2A-2ivfC:
22.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2opt ACTII PROTEIN

(Streptomyces
coelicolor) 		PF00440
(TetR_N)
PF02909
(TetR_C) 		5 PHE A 115
MET A 114
VAL A  86
LEU A 111
PHE A  83
 None
 1.23A 5im2A-2optA:
undetectable		 5im2A-2optA:
21.97
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.
2qt5 GLUTAMATE
RECEPTOR-INTERACTING
PROTEIN 1

(Rattus
norvegicus) 		PF00595
(PDZ) 		5 VAL A 128
ILE A 118
LEU A 120
LEU A 109
VAL A 104
 None
 1.25A 5im2A-2qt5A:
undetectable		 5im2A-2qt5A:
17.30
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.
2qw7 CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
CCML

(Synechocystis
sp. PCC 6803) 		PF03319
(EutN_CcmL) 		5 MET A  77
VAL A  46
LEU A  74
LEU A  19
VAL A  22
 None
 1.02A 5im2A-2qw7A:
undetectable		 5im2A-2qw7A:
16.36
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.
2reo PUTATIVE
SULFOTRANSFERASE 1C3

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		5 MET A  62
VAL A 137
ILE A 213
LEU A  66
VAL A 135
 None
 1.25A 5im2A-2reoA:
undetectable		 5im2A-2reoA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rt5 MSX2-INTERACTING
PROTEIN

(Homo sapiens) 		PF07744
(SPOC) 		5 PHE A3599
PRO A3546
LEU A3513
VAL A3522
GLN A3591
 None
 1.26A 5im2A-2rt5A:
undetectable		 5im2A-2rt5A:
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.
2v1u CELL DIVISION
CONTROL PROTEIN 6
HOMOLOG

(Aeropyrum
pernix) 		PF09079
(Cdc6_C)
PF13191
(AAA_16) 		5 PHE A 230
ILE A  17
HIS A 280
LEU A 235
VAL A 239
 None
 1.19A 5im2A-2v1uA:
undetectable		 5im2A-2v1uA:
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.
2vrs SIGMA-C CAPSID
PROTEIN

(Avian
orthoreovirus) 		PF04582
(Reo_sigmaC) 		5 VAL A 218
ILE A 324
PRO A 265
LEU A 263
LEU A 250
 None
 1.17A 5im2A-2vrsA:
undetectable		 5im2A-2vrsA:
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.
2w7q OUTER-MEMBRANE
LIPOPROTEIN CARRIER
PROTEIN

(Pseudomonas
aeruginosa) 		PF03548
(LolA) 		5 VAL A 180
PRO A 109
LEU A 113
LEU A 153
VAL A 160
 None
 1.17A 5im2A-2w7qA:
undetectable		 5im2A-2w7qA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2www METHYLMALONIC
ACIDURIA TYPE A
PROTEIN,
MITOCHONDRIAL

(Homo sapiens) 		PF03308
(ArgK) 		5 TRP A 366
ILE A 228
HIS A 130
LEU A 230
VAL A 126
 None
 1.15A 5im2A-2wwwA:
undetectable		 5im2A-2wwwA:
23.65
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.
2x7j 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE
-1-CARBOXYLATE
SYNTHASE

(Bacillus
subtilis) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		5 PHE A 534
PRO A 395
LEU A 390
LEU A 400
VAL A 454
 None
 1.12A 5im2A-2x7jA:
undetectable		 5im2A-2x7jA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zu6 EUKARYOTIC
INITIATION FACTOR
4A-I

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 PHE A 179
PRO A 173
LEU A 104
LEU A 171
VAL A 162
 None
 1.08A 5im2A-2zu6A:
1.8		 5im2A-2zu6A:
23.98
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.
3abz BETA-GLUCOSIDASE I

(Kluyveromyces
marxianus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF07691
(PA14)
PF14310
(Fn3-like) 		5 ILE A 321
PRO A 662
LEU A 656
LEU A 331
VAL A 618
 None
 1.17A 5im2A-3abzA:
undetectable		 5im2A-3abzA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b33 SENSOR PROTEIN

(Vibrio
parahaemolyticus) 		PF00989
(PAS) 		5 PHE A  37
ILE A  53
LEU A  20
VAL A 106
PHE A  80
 None
 1.10A 5im2A-3b33A:
undetectable		 5im2A-3b33A:
14.55
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.
3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE

(Mycolicibacterium
smegmatis) 		PF01063
(Aminotran_4) 		5 PHE A 248
VAL A 324
ILE A 292
LEU A 246
VAL A 228
 None
 1.19A 5im2A-3dtgA:
undetectable		 5im2A-3dtgA:
23.52
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.
3ez4 3-METHYL-2-OXOBUTANO
ATE
HYDROXYMETHYLTRANSFE
RASE

(Burkholderia
pseudomallei) 		PF02548
(Pantoate_transf) 		5 MET A  10
ILE A 198
LEU A   7
LEU A  78
VAL A   2
 None
 1.22A 5im2A-3ez4A:
undetectable		 5im2A-3ez4A:
24.54
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.
3h3b RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-2

(Homo sapiens) 		PF01030
(Recep_L_domain) 		5 VAL A 131
TRP A 147
LEU A 118
LEU A 115
VAL A  94
 None
 1.11A 5im2A-3h3bA:
undetectable		 5im2A-3h3bA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h75 PERIPLASMIC
SUGAR-BINDING DOMAIN
PROTEIN

(Pseudomonas
protegens) 		PF13407
(Peripla_BP_4) 		5 PHE A 105
ILE A 126
LEU A 104
LEU A  88
VAL A  55
 None
 0.92A 5im2A-3h75A:
undetectable		 5im2A-3h75A:
24.16
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.
3if2 AMINOTRANSFERASE

(Psychrobacter
arcticus) 		PF00155
(Aminotran_1_2) 		5 VAL A 190
ILE A 233
LEU A 147
LEU A 198
VAL A 170
 None
 1.27A 5im2A-3if2A:
undetectable		 5im2A-3if2A:
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.
3j26 CAPSID PROTEIN V20

(Mimivirus-dependent
virus Sputnik) 		no annotation 5 MET A 460
ILE A 354
LEU A 328
LEU A 359
VAL A 443
 None
 1.25A 5im2A-3j26A:
undetectable		 5im2A-3j26A:
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.
3j2j PROTEIN VP3

(Enterovirus B) 		PF00073
(Rhv) 		5 PHE B 118
VAL B  55
ILE B 132
LEU B 116
LEU B  87
 None
 1.24A 5im2A-3j2jB:
undetectable		 5im2A-3j2jB:
20.42
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.
3j4u MAJOR CAPSID PROTEIN

(Bordetella
virus BPP1) 		no annotation 5 PHE A 131
ILE A  38
LEU A 145
LEU A 183
VAL A 234
 None
 1.24A 5im2A-3j4uA:
undetectable		 5im2A-3j4uA:
22.67
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.
3mam OSMOPROTECTION
PROTEIN (PROX)

(Archaeoglobus
fulgidus) 		PF04069
(OpuAC) 		5 PHE A 164
ILE A 156
LEU A 131
LEU A 204
VAL A 115
 None
 1.25A 5im2A-3mamA:
8.1		 5im2A-3mamA:
21.91
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.
3ppc 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Candida
albicans) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 PHE A 134
ILE A 196
PRO A 171
LEU A 169
VAL A  69
 None
 1.20A 5im2A-3ppcA:
1.9		 5im2A-3ppcA:
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.
3pry HEAT SHOCK PROTEIN
HSP 90-BETA

(Homo sapiens) 		PF00183
(HSP90) 		5 PHE A 376
ILE A 335
LEU A 374
LEU A 413
PHE A 429
 None
 1.25A 5im2A-3pryA:
undetectable		 5im2A-3pryA:
18.86
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.
3psf TRANSCRIPTION
ELONGATION FACTOR
SPT6

(Saccharomyces
cerevisiae) 		PF14635
(HHH_7)
PF14639
(YqgF)
PF14641
(HTH_44)
PF14878
(DLD) 		5 PHE A 795
ILE A 765
LEU A 799
LEU A 751
PHE A 823
 None
 1.08A 5im2A-3psfA:
undetectable		 5im2A-3psfA:
16.13
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.
3psi TRANSCRIPTION
ELONGATION FACTOR
SPT6

(Saccharomyces
cerevisiae) 		PF14635
(HHH_7)
PF14639
(YqgF)
PF14641
(HTH_44)
PF14878
(DLD) 		5 PHE A 795
ILE A 765
LEU A 799
LEU A 751
PHE A 823
 None
 1.07A 5im2A-3psiA:
undetectable		 5im2A-3psiA:
14.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r44 FATTY ACYL COA
SYNTHETASE FADD13
(FATTY-ACYL-COA
SYNTHETASE)

(Mycobacterium
tuberculosis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 MET A 258
VAL A 236
ILE A 295
LEU A 255
PHE A 272
 None
 1.27A 5im2A-3r44A:
1.2		 5im2A-3r44A:
22.86
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.
3rip GAMMA-TUBULIN
COMPLEX COMPONENT 4

(Homo sapiens) 		PF04130
(Spc97_Spc98) 		5 PHE A 618
TRP A 495
LEU A 614
LEU A 595
GLN A 498
 None
 1.09A 5im2A-3ripA:
undetectable		 5im2A-3ripA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s97 CONTACTIN-1

(Homo sapiens) 		PF07679
(I-set)
PF13927
(Ig_3) 		5 ILE C 218
PRO C 165
LEU C 135
LEU C 168
VAL C 213
 None
 1.26A 5im2A-3s97C:
undetectable		 5im2A-3s97C:
20.69
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.
3u5z DNA POLYMERASE
ACCESSORY PROTEIN 44

(Escherichia
virus T4) 		PF00004
(AAA) 		5 VAL B 288
ILE B 235
LEU B 242
LEU B 250
PHE B 264
 None
 1.18A 5im2A-3u5zB:
undetectable		 5im2A-3u5zB:
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.
3ujh GLUCOSE-6-PHOSPHATE
ISOMERASE

(Toxoplasma
gondii) 		PF00342
(PGI) 		5 ILE A 184
LEU A 289
LEU A 169
VAL A 165
PHE A 186
 None
 1.15A 5im2A-3ujhA:
undetectable		 5im2A-3ujhA:
21.45
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.
3ut3 PLASMINOGEN
ACTIVATOR INHIBITOR
1

(Homo sapiens) 		PF00079
(Serpin) 		5 VAL A 284
LEU A 290
LEU A  43
PHE A  34
GLN A 322
 None
 1.20A 5im2A-3ut3A:
undetectable		 5im2A-3ut3A:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wks O-PHOSPHO-L-SERYL-TR
NA:CYS-TRNA SYNTHASE

(Methanocaldococcus
jannaschii) 		PF05889
(SepSecS) 		5 PHE A 315
VAL A 392
ILE A 369
LEU A 310
PHE A 349
 None
 1.17A 5im2A-3wksA:
undetectable		 5im2A-3wksA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4drt DE NOVO DESIGNED
SERINE HYDROLASE,
OR89

(synthetic
construct) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		5 ILE A 353
LEU A 320
LEU A 291
VAL A 330
GLN A 328
 None
 1.25A 5im2A-4drtA:
undetectable		 5im2A-4drtA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fie SERINE/THREONINE-PRO
TEIN KINASE PAK 4

(Homo sapiens) 		PF00069
(Pkinase)
PF00786
(PBD) 		5 VAL A 407
ILE A 503
PRO A 533
LEU A 535
VAL A 509
 None
 1.26A 5im2A-4fieA:
undetectable		 5im2A-4fieA:
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.
4h65 PYRIMIDINE PRECURSOR
BIOSYNTHESIS ENZYME
THI5

(Saccharomyces
cerevisiae) 		PF09084
(NMT1) 		5 PHE A  30
ILE A  21
PRO A  20
LEU A 269
PHE A   8
 None
 1.27A 5im2A-4h65A:
5.8		 5im2A-4h65A:
22.85
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.
4iik ADENOSINE
MONOPHOSPHATE-PROTEI
N HYDROLASE SIDD

(Legionella
pneumophila) 		no annotation 5 PHE A 220
ILE A 153
LEU A 131
VAL A 128
PHE A 188
 None
 1.23A 5im2A-4iikA:
undetectable		 5im2A-4iikA:
22.59
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.
4ku4 RAS-3 FROM
CRYPHONECTRIA
PARASITICA

(Cryphonectria
parasitica) 		PF00071
(Ras) 		5 PHE A 183
VAL A 138
ILE A  63
LEU A  27
VAL A  89
 None
 1.26A 5im2A-4ku4A:
undetectable		 5im2A-4ku4A:
19.83
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.
4mhb PUTATIVE ALDO/KETO
REDUCTASE

(Yersinia pestis) 		PF00248
(Aldo_ket_red) 		5 PHE A  84
VAL A 238
ILE A  24
LEU A 117
VAL A 169
 None
 1.13A 5im2A-4mhbA:
undetectable		 5im2A-4mhbA:
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.
4mmo SSO-CP2
METALLO-CARBOXYPETID
ASE

(Sulfolobus
solfataricus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 VAL A  54
ILE A  68
LEU A 113
LEU A  39
VAL A  35
 None
 1.27A 5im2A-4mmoA:
undetectable		 5im2A-4mmoA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pag PERIPLASMIC BINDING
PROTEIN

(Sulfurospirillum
deleyianum) 		PF01497
(Peripla_BP_2) 		5 ILE A 109
PRO A 131
LEU A 133
LEU A  32
VAL A 153
 None
 1.24A 5im2A-4pagA:
undetectable		 5im2A-4pagA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q76 CYSTEINE DESULFURASE
2, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00266
(Aminotran_5) 		5 HIS A 186
PRO A 167
LEU A 388
LEU A 192
VAL A 191
 None
 1.27A 5im2A-4q76A:
undetectable		 5im2A-4q76A:
22.62
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.
4ric FANCONI-ASSOCIATED
NUCLEASE 1

(Homo sapiens) 		PF08774
(VRR_NUC) 		5 VAL A 674
LEU A 711
LEU A 715
VAL A 687
GLN A 678
 None
 1.13A 5im2A-4ricA:
undetectable		 5im2A-4ricA:
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.
4um8 INTEGRIN ALPHA-V

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 MET A 408
ILE A 433
LEU A 422
LEU A   3
PHE A 404
 None
 1.16A 5im2A-4um8A:
undetectable		 5im2A-4um8A:
20.67
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.
4xbr PROTEIN
FAM212A,SERINE/THREO
NINE-PROTEIN KINASE
PAK 4

(Homo sapiens) 		PF00069
(Pkinase)
PF15342
(FAM212) 		5 VAL A 407
ILE A 503
PRO A 533
LEU A 535
VAL A 509
 None
 1.18A 5im2A-4xbrA:
undetectable		 5im2A-4xbrA:
23.09
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.
4xz8 NUCLEOPROTEIN

(Thiafora
orthonairovirus) 		PF02477
(Nairo_nucleo) 		5 MET A  88
VAL A 141
TRP A 137
LEU A  82
LEU A 146
 None
 1.01A 5im2A-4xz8A:
undetectable		 5im2A-4xz8A:
22.00
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.
4y4s EXTRACELLULAR HEME
ACQUISITION
HEMOPHORE HASA

(Yersinia
pseudotuberculosis) 		PF06438
(HasA) 		5 PHE A 125
MET A 139
VAL A 143
LEU A 121
LEU A 119
 None
 1.17A 5im2A-4y4sA:
undetectable		 5im2A-4y4sA:
20.97
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.
4yer ABC TRANSPORTER
ATP-BINDING PROTEIN

(Thermotoga
maritima) 		PF00005
(ABC_tran)
PF13732
(DUF4162) 		5 VAL A  27
ILE A  47
LEU A  10
VAL A   7
PHE A 190
 None
 1.23A 5im2A-4yerA:
undetectable		 5im2A-4yerA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z7e LMO1422 PROTEIN

(Listeria
monocytogenes) 		PF04069
(OpuAC) 		5 PHE A 392
ILE A 384
LEU A 359
LEU A 432
VAL A 343
 None
 1.19A 5im2A-4z7eA:
6.7		 5im2A-4z7eA:
24.23
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.
4zht BIFUNCTIONAL
UDP-N-ACETYLGLUCOSAM
INE
2-EPIMERASE/N-ACETYL
MANNOSAMINE KINASE

(Homo sapiens) 		PF02350
(Epimerase_2) 		5 VAL A  12
ILE A 370
PRO A 184
LEU A  25
VAL A  14
 None
 1.11A 5im2A-4zhtA:
undetectable		 5im2A-4zhtA:
20.87
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.
4zo6 LIN1840 PROTEIN

(Listeria
innocua) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 MET A 210
VAL A 208
LEU A 215
LEU A 252
VAL A 241
 None
 1.18A 5im2A-4zo6A:
undetectable		 5im2A-4zo6A:
21.35
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.
5cdo DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B

(Staphylococcus
aureus) 		PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		5 PHE B 524
ILE B 503
LEU B 520
LEU B 457
PHE B 485
 None
 1.26A 5im2A-5cdoB:
undetectable		 5im2A-5cdoB:
20.69
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.
5fdn PHOSPHOENOLPYRUVATE
CARBOXYLASE 3

(Arabidopsis
thaliana) 		PF00311
(PEPcase) 		5 PHE A 255
VAL A 166
ILE A 139
LEU A 256
GLN A 164
 None
 1.12A 5im2A-5fdnA:
undetectable		 5im2A-5fdnA:
17.98
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.
5hmq 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Pseudomonas
putida) 		PF00903
(Glyoxalase)
PF01261
(AP_endonuc_2)
PF14696
(Glyoxalase_5) 		5 MET A   1
VAL A 283
ILE A 227
LEU A 236
LEU A 264
 None
 1.25A 5im2A-5hmqA:
undetectable		 5im2A-5hmqA:
19.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i5p TRAP TRANSPORTER
SOLUTE BINDING
PROTEIN

(uncultured
marine
bacterium) 		PF03480
(DctP) 		5 PHE A  33
TRP A  90
HIS A 145
PRO A 171
PHE A 239
 PHB  A 401 ( 4.5A)
None
PHB  A 401 ( 4.2A)
PHB  A 401 (-4.2A)
PHB  A 401 ( 4.1A)
 0.61A 5im2A-5i5pA:
49.0		 5im2A-5i5pA:
50.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5im2 TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL

(Rhodoferax
ferrireducens) 		PF03480
(DctP) 		12 PHE A  34
MET A  35
VAL A  41
TRP A  91
ILE A  93
HIS A 146
PRO A 172
LEU A 192
LEU A 209
VAL A 213
PHE A 241
GLN A 277
 BEZ  A 401 ( 4.1A)
BEZ  A 401 ( 2.9A)
None
None
BEZ  A 401 (-4.9A)
BEZ  A 401 ( 4.2A)
BEZ  A 401 (-4.3A)
BEZ  A 401 ( 3.8A)
BEZ  A 401 (-4.5A)
BEZ  A 401 ( 3.9A)
BEZ  A 401 ( 4.9A)
BEZ  A 401 (-3.9A)
 0.00A 5im2A-5im2A:
59.8		 5im2A-5im2A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j9z EPIDERMAL GROWTH
FACTOR RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 MET A 908
VAL A 904
PRO A 975
LEU A 979
VAL A 943
 None
 1.24A 5im2A-5j9zA:
undetectable		 5im2A-5j9zA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jh5 LYSINE-SPECIFIC
DEMETHYLASE 2B

(Homo sapiens) 		PF00646
(F-box) 		5 VAL A1281
ILE A1273
LEU A1245
LEU A1230
VAL A1251
 None
 1.27A 5im2A-5jh5A:
undetectable		 5im2A-5jh5A:
19.61
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.
5jou ALPHA-XYLOSIDASE
BOGH31A

(Bacteroides
ovatus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		5 PHE A 290
VAL A 307
ILE A 280
LEU A 350
VAL A 300
 None
 1.27A 5im2A-5jouA:
undetectable		 5im2A-5jouA:
17.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kbf CAMP-DEPENDENT
PROTEIN KINASE
REGULATORY SUBUNIT,
PUTATIVE

(Plasmodium
falciparum) 		PF00027
(cNMP_binding) 		5 PHE A 205
VAL A 256
ILE A 201
LEU A 262
PHE A 190
 None
 1.02A 5im2A-5kbfA:
undetectable		 5im2A-5kbfA:
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.
5lqv NON-SPECIFIC
LIPID-TRANSFER
PROTEIN 2

(Lens culinaris) 		PF00234
(Tryp_alpha_amyl) 		5 VAL A  76
ILE A  82
LEU A  70
LEU A  11
VAL A  32
 None
PGM  A 101 (-3.4A)
None
PGM  A 101 ( 4.4A)
None
 1.15A 5im2A-5lqvA:
undetectable		 5im2A-5lqvA:
13.33
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.
5m3l HEMOGLOBIN CHAIN D1

(Lumbricus
terrestris) 		PF00042
(Globin) 		5 PHE D  53
VAL D  73
TRP D  39
ILE D  49
LEU D 106
 HEM  D 201 (-4.3A)
HEM  D 201 ( 4.8A)
None
None
None
 1.12A 5im2A-5m3lD:
undetectable		 5im2A-5m3lD:
15.93
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.
5m8h ATP
PHOSPHORIBOSYLTRANSF
ERASE

(Psychrobacter
arcticus) 		PF01634
(HisG) 		5 PHE E 223
VAL E  90
ILE E 219
LEU E  41
PHE E  88
 None
 1.24A 5im2A-5m8hE:
6.4		 5im2A-5m8hE:
21.54
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.
5n4a INTRAFLAGELLAR
TRANSPORT PROTEIN 80

(Chlamydomonas
reinhardtii) 		no annotation 5 PRO A 366
LEU A 347
LEU A 363
VAL A 319
PHE A 333
 None
 1.07A 5im2A-5n4aA:
undetectable		 5im2A-5n4aA:
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.
5n4a INTRAFLAGELLAR
TRANSPORT PROTEIN 80

(Chlamydomonas
reinhardtii) 		no annotation 5 VAL A 311
PRO A 366
LEU A 347
LEU A 363
PHE A 333
 None
 1.07A 5im2A-5n4aA:
undetectable		 5im2A-5n4aA:
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.
5nux CHROMATE REDUCTASE

(Thermus
scotoductus) 		no annotation 5 VAL A 212
ILE A  99
LEU A 162
LEU A 220
VAL A 216
 None
 1.16A 5im2A-5nuxA:
undetectable		 5im2A-5nuxA:
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.
5vvr DNA REPAIR AND
RECOMBINATION
PROTEIN RAD26

(Saccharomyces
cerevisiae) 		no annotation 5 VAL M 349
ILE M 333
LEU M 496
VAL M 467
PHE M 365
 None
 1.21A 5im2A-5vvrM:
2.6		 5im2A-5vvrM:
14.61
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.
5wa2 SURFACE ANTIGEN

(Toxoplasma
gondii) 		no annotation 5 VAL A 196
PRO A 169
LEU A 173
VAL A 198
PHE A 166
 None
 1.26A 5im2A-5wa2A:
undetectable		 5im2A-5wa2A:
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.
5x55 PROBABLE URACIL-DNA
GLYCOSYLASE

(Acanthamoeba
polyphaga
mimivirus) 		PF03167
(UDG) 		5 PHE A 351
VAL A 185
ILE A 224
PRO A 319
VAL A 293
 None
 1.19A 5im2A-5x55A:
undetectable		 5im2A-5x55A:
18.78
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.
5z9s GLYCOSYL HYDROLASE
FAMILY 3 PROTEIN

(Bifidobacterium
longum) 		no annotation 5 ILE A 771
LEU A 696
VAL A 732
PHE A 744
GLN A 730
 None
 1.20A 5im2A-5z9sA:
undetectable		 5im2A-5z9sA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zrt -

(-) 		no annotation 5 PHE A 110
VAL A  98
TRP A  27
LEU A  18
PHE A  25
 None
 1.23A 5im2A-5zrtA:
undetectable		 5im2A-5zrtA:
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.
6cri -

(-) 		no annotation 5 PHE M 255
LEU M 210
LEU M 204
VAL M 171
PHE M 262
 None
 1.25A 5im2A-6criM:
undetectable		 5im2A-6criM:
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.
6deg BETA SLIDING CLAMP

(Bartonella
birtlesii) 		no annotation 5 MET A 196
ILE A 223
LEU A 225
LEU A 243
VAL A 199
 None
 1.10A 5im2A-6degA:
undetectable		 5im2A-6degA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p56 PUTATIVE
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN

(Bordetella
bronchiseptica) 		PF03480
(DctP) 		4 TYR A  94
ARG A 170
PRO A 210
GLU A 212
 RMN  A 401 (-4.6A)
RMN  A 401 (-2.8A)
RMN  A 401 ( 4.4A)
RMN  A 401 ( 4.4A)
 0.95A 5im2A-4p56A:
40.9		 5im2A-4p56A:
32.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i5p TRAP TRANSPORTER
SOLUTE BINDING
PROTEIN

(uncultured
marine
bacterium) 		PF03480
(DctP) 		4 TYR A  95
ARG A 169
PRO A 209
GLU A 211
 PHB  A 401 (-4.5A)
PHB  A 401 (-3.0A)
PHB  A 401 ( 4.0A)
PHB  A 401 (-3.1A)
 0.28A 5im2A-5i5pA:
49.0		 5im2A-5i5pA:
50.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5im2 TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL

(Rhodoferax
ferrireducens) 		PF03480
(DctP) 		4 TYR A  96
ARG A 170
PRO A 210
GLU A 212
 BEZ  A 401 (-4.8A)
BEZ  A 401 (-2.8A)
BEZ  A 401 (-3.8A)
BEZ  A 401 (-3.6A)
 0.03A 5im2A-5im2A:
59.8		 5im2A-5im2A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lcw CELL DIVISION CYCLE
PROTEIN 20 HOMOLOG
MITOTIC CHECKPOINT
SERINE/THREONINE-PRO
TEIN KINASE BUB1
BETA,MITOTIC
CHECKPOINT
SERINE/THREONINE-PRO
TEIN KINASE BUB1
BETA

(Homo sapiens;
Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40)
PF08311
(Mad3_BUB1_I) 		4 TYR R 228
ARG R 286
PRO S 135
GLU S 161
 None
 1.47A 5im2A-5lcwR:
0.0		 5im2A-5lcwR:
21.78