SIMILAR PATTERNS OF AMINO ACIDS FOR 5XIW_B_LOCB504_2

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.
1a75 PARVALBUMIN

(Merlangius
merlangus) 		PF13499
(EF-hand_7) 		5 LEU A  35
LEU A 105
ILE A  50
ALA A  46
ILE A  97
 None
 0.99A 5xiwB-1a75A:
undetectable		 5xiwB-1a75A:
18.10
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.
1b3n PROTEIN (KETOACYL
ACYL CARRIER PROTEIN
SYNTHASE 2)

(Escherichia
coli) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 LEU A 240
ALA A 174
THR A 164
ALA A 187
ILE A 159
 None
 1.02A 5xiwB-1b3nA:
undetectable		 5xiwB-1b3nA:
11.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		6 LEU A 197
THR A 241
ALA A 239
ILE A   3
ALA A 226
ILE A 236
 None
 1.18A 5xiwB-1f6yA:
2.5		 5xiwB-1f6yA:
14.23
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.
1g61 TRANSLATION
INITIATION FACTOR 6

(Methanocaldococcus
jannaschii) 		PF01912
(eIF-6) 		5 LEU A2020
LEU A2107
LEU A2070
ILE A2053
ILE A2084
 None
 0.93A 5xiwB-1g61A:
undetectable		 5xiwB-1g61A:
18.35
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.
1gz4 NAD-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		5 LEU A 512
ALA A 293
LEU A 291
ALA A 444
ILE A 390
 None
 1.00A 5xiwB-1gz4A:
2.2		 5xiwB-1gz4A:
9.17
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.
1h6u INTERNALIN H

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6) 		6 LEU A 103
ALA A  83
LEU A  53
ILE A  78
LYS A  58
ALA A  60
 None
 1.07A 5xiwB-1h6uA:
undetectable		 5xiwB-1h6uA:
13.44
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.
1i8a ENDO-1,4-BETA-XYLANA
SE A

(Thermotoga
maritima) 		PF06452
(CBM9_1) 		5 LEU A  52
LEU A 184
ASN A 183
ILE A 150
ILE A  25
 None
 0.98A 5xiwB-1i8aA:
undetectable		 5xiwB-1i8aA:
20.86
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.
1kh2 ARGININOSUCCINATE
SYNTHETASE

(Thermus
thermophilus) 		PF00764
(Arginosuc_synth) 		5 LEU A  99
ALA A 112
THR A  51
ALA A  53
ILE A  29
 None
 0.91A 5xiwB-1kh2A:
undetectable		 5xiwB-1kh2A:
12.50
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.
1kyh HYPOTHETICAL 29.9
KDA PROTEIN IN
SIGY-CYDD INTERGENIC
REGION

(Bacillus
subtilis) 		PF01256
(Carb_kinase) 		5 CYH A 227
LEU A  55
ALA A 100
ALA A  30
ILE A 126
 None
 0.82A 5xiwB-1kyhA:
3.0		 5xiwB-1kyhA:
14.50
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.
1l0q SURFACE LAYER
PROTEIN

(Methanosarcina
mazei) 		PF00801
(PKD)
PF10282
(Lactonase) 		5 THR A   2
ALA A   4
ILE A   6
ALA A 290
ILE A  17
 None
 0.88A 5xiwB-1l0qA:
undetectable		 5xiwB-1l0qA:
12.50
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.
1l8w VLSE1

(Borreliella
burgdorferi) 		PF00921
(Lipoprotein_2) 		5 LEU A 286
ALA A 259
ASN A 254
ALA A 234
ILE A 231
 None
 0.90A 5xiwB-1l8wA:
undetectable		 5xiwB-1l8wA:
12.54
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.
1mtp SERINE PROTEINASE
INHIBITOR (SERPIN),
CHAIN A

(Thermobifida
fusca) 		PF00079
(Serpin) 		5 LEU A 145
THR A 298
ALA A 319
ALA A 317
ILE A 157
 None
 0.83A 5xiwB-1mtpA:
undetectable		 5xiwB-1mtpA:
14.43
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 LEU A1365
ALA A1392
ILE A1394
ALA A1375
ILE A1410
 None
 1.01A 5xiwB-1ofeA:
undetectable		 5xiwB-1ofeA:
4.54
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.
1ptj NAD(P)
TRANSHYDROGENASE
SUBUNIT ALPHA PART 1

(Rhodospirillum
rubrum) 		PF01262
(AlaDh_PNT_C)
PF05222
(AlaDh_PNT_N) 		5 LEU A  50
ALA A  39
ILE A  34
ALA A  64
ILE A   3
 None
 0.84A 5xiwB-1ptjA:
undetectable		 5xiwB-1ptjA:
10.88
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.
1rkv HOMOSERINE KINASE

(Pseudomonas
aeruginosa) 		PF12710
(HAD) 		5 LEU A  80
LEU A 191
ALA A 150
ILE A 148
ALA A   4
 None
 1.01A 5xiwB-1rkvA:
3.7		 5xiwB-1rkvA:
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.
1rkv HOMOSERINE KINASE

(Pseudomonas
aeruginosa) 		PF12710
(HAD) 		5 LEU A 191
ALA A 150
ILE A 148
ALA A   4
ILE A 167
 None
 0.99A 5xiwB-1rkvA:
3.7		 5xiwB-1rkvA:
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.
1rkv HOMOSERINE KINASE

(Pseudomonas
aeruginosa) 		PF12710
(HAD) 		5 LEU A 196
ALA A 150
ILE A 148
ALA A   4
ILE A 167
 None
 0.95A 5xiwB-1rkvA:
3.7		 5xiwB-1rkvA:
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.
1t6p PHENYLALANINE
AMMONIA-LYASE

(Rhodotorula
toruloides) 		PF00221
(Lyase_aromatic) 		5 LEU A 386
ASN A 420
THR A 489
ALA A 506
ALA A 279
 None
 1.01A 5xiwB-1t6pA:
undetectable		 5xiwB-1t6pA:
7.08
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.
1tig TRANSLATION
INITIATION FACTOR 3

(Geobacillus
stearothermophilus) 		PF00707
(IF3_C) 		5 CYH A 144
LEU A 110
ALA A 148
ALA A 118
ALA A 106
 None
 0.90A 5xiwB-1tigA:
undetectable		 5xiwB-1tigA:
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.
1ur4 GALACTANASE

(Bacillus
licheniformis) 		PF07745
(Glyco_hydro_53) 		5 ALA A 149
LEU A 147
ALA A 107
ILE A  69
ALA A  91
 None
 0.77A 5xiwB-1ur4A:
2.8		 5xiwB-1ur4A:
11.62
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.
1vbl PECTATE LYASE 47

(Bacillus sp.
TS-47) 		PF00544
(Pec_lyase_C) 		5 LEU A  69
LEU A  41
ILE A 163
ALA A 143
ILE A 136
 None
 1.01A 5xiwB-1vblA:
undetectable		 5xiwB-1vblA:
13.12
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.
1vma CELL DIVISION
PROTEIN FTSY

(Thermotoga
maritima) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 LEU A 216
LEU A 244
THR A 221
ALA A 230
ILE A 255
 None
 1.01A 5xiwB-1vmaA:
4.0		 5xiwB-1vmaA:
13.07
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.
1w99 PESTICIDIAL CRYSTAL
PROTEIN CRY4BA

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		5 LEU A 517
LEU A 511
ALA A 495
THR A 609
ALA A 611
 None
 0.98A 5xiwB-1w99A:
undetectable		 5xiwB-1w99A:
10.11
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.
1xcr HYPOTHETICAL PROTEIN
PTD012

(Homo sapiens) 		PF08925
(DUF1907) 		5 CYH A 140
LEU A 142
THR A 267
ILE A 218
ALA A 131
 None
 0.95A 5xiwB-1xcrA:
undetectable		 5xiwB-1xcrA:
14.29
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.
1ypx PUTATIVE VITAMIN-B12
INDEPENDENT
METHIONINE SYNTHASE
FAMILY PROTEIN

(Listeria
monocytogenes) 		PF01717
(Meth_synt_2) 		5 LEU A 186
ALA A 224
ILE A 173
ALA A 172
ILE A 225
 None
 0.97A 5xiwB-1ypxA:
3.3		 5xiwB-1ypxA:
13.35
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.
2aie PEPTIDE DEFORMYLASE

(Streptococcus
pneumoniae) 		PF01327
(Pep_deformylase) 		5 LEU P  77
ALA P  85
ILE P  83
ALA P  74
ILE P 107
 None
 0.87A 5xiwB-2aieP:
undetectable		 5xiwB-2aieP:
16.58
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.
2btv PROTEIN (VP3 CORE
PROTEIN)
PROTEIN (VP7 CORE
PROTEIN)

(Bluetongue
virus) 		PF01700
(Orbi_VP3)
no annotation 		5 LEU P  18
ALA P  14
THR A 447
ILE P  37
ALA P  36
 None
 0.94A 5xiwB-2btvP:
undetectable		 5xiwB-2btvP:
13.31
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.
2cvz 3-HYDROXYISOBUTYRATE
DEHYDROGENASE

(Thermus
thermophilus) 		PF03446
(NAD_binding_2)
PF14833
(NAD_binding_11) 		5 LEU A  63
LEU A   9
ALA A   5
ALA A  17
ILE A  59
 NDP  A1302 (-4.2A)
None
None
None
None
 0.88A 5xiwB-2cvzA:
3.8		 5xiwB-2cvzA:
14.39
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.
2dc1 L-ASPARTATE
DEHYDROGENASE

(Archaeoglobus
fulgidus) 		PF01958
(DUF108)
PF03447
(NAD_binding_3) 		5 LEU A  80
ALA A  57
LEU A  15
ILE A 226
ALA A 108
 NAD  A 242 (-4.1A)
NAD  A 242 ( 4.9A)
None
None
None
 0.96A 5xiwB-2dc1A:
4.0		 5xiwB-2dc1A:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ell ACIDIC LEUCINE-RICH
NUCLEAR
PHOSPHOPROTEIN 32
FAMILY MEMBER B

(Homo sapiens) 		PF14580
(LRR_9) 		5 LEU A 116
LEU A  97
LEU A 102
ASN A 101
ILE A  83
 None
 0.98A 5xiwB-2ellA:
undetectable		 5xiwB-2ellA:
17.31
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.
2gfq UPF0204 PROTEIN
PH0006

(Pyrococcus
horikoshii) 		PF04414
(tRNA_deacylase) 		6 LEU A 179
LEU A  20
ALA A  77
ILE A 153
ALA A  75
ILE A  16
 None
 1.35A 5xiwB-2gfqA:
undetectable		 5xiwB-2gfqA:
12.04
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.
2ivp O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE

(Pyrococcus
abyssi) 		PF00814
(Peptidase_M22) 		5 LEU A  84
ALA A  73
ILE A   6
ALA A  91
ILE A 290
 None
 0.99A 5xiwB-2ivpA:
2.2		 5xiwB-2ivpA:
12.73
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.
2j8i NP275

(Nostoc
punctiforme) 		PF00805
(Pentapeptide) 		5 LEU A  47
ALA A  45
LEU A  22
ILE A  30
ALA A  50
 None
 1.01A 5xiwB-2j8iA:
undetectable		 5xiwB-2j8iA:
22.50
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.
2j8k NP275-NP276

(Nostoc
punctiforme) 		PF00805
(Pentapeptide) 		5 LEU A  47
ALA A  45
LEU A  22
ILE A  30
ALA A  50
 None
 1.02A 5xiwB-2j8kA:
undetectable		 5xiwB-2j8kA:
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.
2jjy ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE

(Francisella
tularensis) 		PF13561
(adh_short_C2) 		5 LEU A 144
THR A  12
ALA A  21
ILE A 222
ILE A  24
 None
 0.96A 5xiwB-2jjyA:
6.6		 5xiwB-2jjyA:
14.34
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.
2la4 NUCLEAR AND
CYTOPLASMIC
POLYADENYLATED
RNA-BINDING PROTEIN
PUB1

(Saccharomyces
cerevisiae) 		PF00076
(RRM_1) 		5 ALA A 395
THR A 341
ALA A 343
ILE A 345
ILE A 381
 None
 1.02A 5xiwB-2la4A:
undetectable		 5xiwB-2la4A:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2m1x TIR
DOMAIN-CONTAINING
ADAPTER MOLECULE 1

(Homo sapiens) 		no annotation 5 LEU A 533
LEU A 416
THR A 426
ALA A 450
ILE A 453
 None
 0.95A 5xiwB-2m1xA:
undetectable		 5xiwB-2m1xA:
16.37
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.
2o1s 1-DEOXY-D-XYLULOSE-5
-PHOSPHATE SYNTHASE

(Escherichia
coli) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
PF13292
(DXP_synthase_N) 		5 LEU A 242
ASN A 165
ALA A 160
ILE A 155
ILE A 127
 None
 1.01A 5xiwB-2o1sA:
undetectable		 5xiwB-2o1sA:
8.46
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.
2oi6 BIFUNCTIONAL PROTEIN
GLMU

(Escherichia
coli) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 LEU A 338
LEU A 367
ALA A 361
ALA A 342
ILE A 378
 None
 0.89A 5xiwB-2oi6A:
undetectable		 5xiwB-2oi6A:
12.62
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.
2p91 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Aquifex
aeolicus) 		PF13561
(adh_short_C2) 		5 LEU A 159
THR A  27
ALA A  36
ILE A 237
ILE A  39
 None
 0.91A 5xiwB-2p91A:
7.2		 5xiwB-2p91A:
13.68
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.
2qo3 ERYAII ERYTHROMYCIN
POLYKETIDE SYNTHASE
MODULES 3 AND 4

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 ALA A 208
LEU A 151
THR A 127
ALA A 224
ILE A 185
 None
 0.86A 5xiwB-2qo3A:
undetectable		 5xiwB-2qo3A:
6.96
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.
2r4q PHOSPHOTRANSFERASE
SYSTEM (PTS)
FRUCTOSE-SPECIFIC
ENZYME IIABC
COMPONENT

(Bacillus
subtilis) 		PF02302
(PTS_IIB) 		5 LEU A 199
THR A 176
ALA A 174
ILE A 172
ILE A 229
 None
 0.98A 5xiwB-2r4qA:
2.3		 5xiwB-2r4qA:
19.09
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.
2v7b BENZOATE-COENZYME A
LIGASE

(Paraburkholderia
xenovorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A 167
LEU A  65
ALA A 123
ILE A 125
ILE A  76
 None
 0.88A 5xiwB-2v7bA:
undetectable		 5xiwB-2v7bA:
7.98
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.
2vfw SHORT-CHAIN
Z-ISOPRENYL
DIPHOSPHATE
SYNTHETASE

(Mycobacterium
tuberculosis) 		PF01255
(Prenyltransf) 		6 CYH A  72
LEU A  69
THR A 212
ILE A  35
ALA A  80
ILE A 210
 None
 1.46A 5xiwB-2vfwA:
undetectable		 5xiwB-2vfwA:
17.18
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.
2vxo GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Homo sapiens) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		5 LEU A 203
ASN A 205
ILE A 103
ALA A 187
ILE A  73
 None
 0.99A 5xiwB-2vxoA:
2.3		 5xiwB-2vxoA:
7.10
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa) 		PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc) 		5 LEU A1022
ALA A1034
LEU A1032
ALA A1094
ILE A1059
 None
 1.02A 5xiwB-2vz9A:
undetectable		 5xiwB-2vz9A:
2.67
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.
2wzf GLUCOSYLTRANSFERASE

(Legionella
pneumophila) 		PF16849
(Glyco_transf_88) 		5 LEU A  35
LEU A  20
ILE A  44
ALA A  19
ILE A  82
 None
 0.97A 5xiwB-2wzfA:
undetectable		 5xiwB-2wzfA:
10.10
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.
2yxd PROBABLE
COBALT-PRECORRIN-6Y
C(15)-METHYLTRANSFER
ASE
[DECARBOXYLATING]

(Methanocaldococcus
jannaschii) 		PF13847
(Methyltransf_31) 		5 THR A 131
ALA A 129
ILE A 127
ALA A 181
ILE A 106
 None
 0.75A 5xiwB-2yxdA:
undetectable		 5xiwB-2yxdA:
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.
2zj8 PUTATIVE SKI2-TYPE
HELICASE

(Pyrococcus
furiosus) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF14520
(HHH_5) 		5 LEU A  32
ALA A  59
ILE A 194
ALA A  42
ILE A  46
 None
 0.92A 5xiwB-2zj8A:
undetectable		 5xiwB-2zj8A:
8.85
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.
3afl OLIGO ALGINATE LYASE

(Agrobacterium
fabrum) 		PF07940
(Hepar_II_III)
PF16332
(DUF4962) 		5 LEU A 316
LEU A 373
THR A 123
ILE A 380
ALA A 377
 None
 0.92A 5xiwB-3aflA:
undetectable		 5xiwB-3aflA:
7.11
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.
3cdx SUCCINYLGLUTAMATEDES
UCCINYLASE/ASPARTOAC
YLASE

(Rhodobacter
sphaeroides) 		PF04952
(AstE_AspA) 		5 LEU A  79
LEU A 236
ASN A 234
ILE A  72
ALA A  71
 None
 1.00A 5xiwB-3cdxA:
undetectable		 5xiwB-3cdxA:
12.75
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.
3ctz XAA-PRO
AMINOPEPTIDASE 1

(Homo sapiens) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2) 		5 LEU A   9
ALA A  63
ILE A  65
ALA A  70
ILE A  32
 None
 0.73A 5xiwB-3ctzA:
undetectable		 5xiwB-3ctzA:
11.58
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.
3fww BIFUNCTIONAL PROTEIN
GLMU

(Yersinia pestis) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 LEU A 338
LEU A 367
ALA A 361
ALA A 342
ILE A 378
 None
 0.96A 5xiwB-3fwwA:
undetectable		 5xiwB-3fwwA:
15.24
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.
3ib6 UNCHARACTERIZED
PROTEIN

(Listeria
monocytogenes) 		PF13419
(HAD_2) 		5 ALA A 108
LEU A 106
ALA A 116
ALA A  53
ILE A 135
 None
 0.88A 5xiwB-3ib6A:
undetectable		 5xiwB-3ib6A:
17.39
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.
3igs N-ACETYLMANNOSAMINE-
6-PHOSPHATE
2-EPIMERASE 2

(Salmonella
enterica) 		PF04131
(NanE) 		6 LEU A   3
ASN A  10
ALA A  49
ILE A 101
ALA A 100
ILE A  18
 None
 1.15A 5xiwB-3igsA:
undetectable		 5xiwB-3igsA:
15.35
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.
3jv9 TRANSCRIPTIONAL
REGULATOR, LYSR
FAMILY

(Neisseria
meningitidis) 		PF03466
(LysR_substrate) 		5 LEU A 106
LEU A 113
LEU A  95
ILE A 293
ALA A 292
 None
 0.75A 5xiwB-3jv9A:
undetectable		 5xiwB-3jv9A:
17.76
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.
3k1j ATP-DEPENDENT
PROTEASE LON

(Thermococcus
onnurineus) 		PF01078
(Mg_chelatase)
PF05362
(Lon_C)
PF13654
(AAA_32) 		5 LEU A 208
ALA A 261
LEU A 258
ALA A 237
ILE A 244
 None
 0.88A 5xiwB-3k1jA:
undetectable		 5xiwB-3k1jA:
10.80
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.
3mdu N-FORMIMINO-L-GLUTAM
ATE IMINOHYDROLASE

(Pseudomonas
aeruginosa) 		PF01979
(Amidohydro_1) 		5 LEU A 290
LEU A 267
ALA A 270
ALA A 282
ALA A 286
 None
 0.94A 5xiwB-3mduA:
2.9		 5xiwB-3mduA:
11.09
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.
3nur AMIDOHYDROLASE

(Staphylococcus
aureus) 		PF04909
(Amidohydro_2) 		5 LEU A 135
ALA A 143
ALA A 182
ILE A 189
ALA A 159
 None
 0.90A 5xiwB-3nurA:
undetectable		 5xiwB-3nurA:
16.16
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.
3o75 FRUCTOSE TRANSPORT
SYSTEM REPRESSOR
FRUR

(Pseudomonas
putida) 		PF00532
(Peripla_BP_1) 		5 ALA A  87
LEU A  83
ILE A 145
ALA A 120
ILE A 147
 None
 0.98A 5xiwB-3o75A:
undetectable		 5xiwB-3o75A:
14.34
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.
3o8o 6-PHOSPHOFRUCTOKINAS
E SUBUNIT BETA

(Saccharomyces
cerevisiae) 		PF00365
(PFK) 		5 LEU B 818
LEU B 734
ALA B 775
ALA B 778
ILE B 494
 None
 1.01A 5xiwB-3o8oB:
undetectable		 5xiwB-3o8oB:
7.16
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.
3oc4 OXIDOREDUCTASE,
PYRIDINE
NUCLEOTIDE-DISULFIDE
FAMILY

(Enterococcus
faecalis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		6 LEU A  -1
LEU A 309
ASN A 307
ALA A  15
ILE A  28
ILE A 106
 None
 1.28A 5xiwB-3oc4A:
undetectable		 5xiwB-3oc4A:
10.19
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.
3r8x METHIONYL-TRNA
FORMYLTRANSFERASE

(Yersinia pestis) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		5 ASN A 302
ALA A 297
ILE A 273
LYS A 270
ALA A 268
 None
 1.01A 5xiwB-3r8xA:
undetectable		 5xiwB-3r8xA:
13.55
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.
3si9 DIHYDRODIPICOLINATE
SYNTHASE

(Bartonella
henselae) 		PF00701
(DHDPS) 		5 ALA A 293
LEU A 244
ALA A 260
LYS A 263
ILE A 257
 None
 1.01A 5xiwB-3si9A:
undetectable		 5xiwB-3si9A:
12.42
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.
3tnl SHIKIMATE
DEHYDROGENASE

(Listeria
monocytogenes) 		PF08501
(Shikimate_dh_N) 		5 CYH A 146
ALA A 142
ASN A 208
ILE A 157
ILE A 205
 None
 1.01A 5xiwB-3tnlA:
undetectable		 5xiwB-3tnlA:
12.54
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.
3twd BIFUNCTIONAL PROTEIN
GLMU

(Escherichia
coli) 		PF00132
(Hexapep) 		5 LEU A 338
LEU A 367
ALA A 361
ALA A 342
ILE A 378
 None
 0.83A 5xiwB-3twdA:
undetectable		 5xiwB-3twdA:
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.
3zdj ENCA BETA-LACTAMASE

(synthetic
construct) 		PF13354
(Beta-lactamase2) 		5 CYH A  77
LEU A  81
LEU A 138
ILE A 127
ALA A 126
 None
 0.88A 5xiwB-3zdjA:
undetectable		 5xiwB-3zdjA:
14.54
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.
4c90 ALPHA-GLUCURONIDASE
GH115

(Bacteroides
ovatus) 		PF15979
(Glyco_hydro_115) 		5 LEU A  86
THR A 100
ALA A  98
ILE A  96
ILE A 145
 None
 0.98A 5xiwB-4c90A:
undetectable		 5xiwB-4c90A:
6.78
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.
4e3w ACID PHOSPHATASE

(Francisella
tularensis) 		PF00328
(His_Phos_2) 		5 ALA A  29
LEU A 170
THR A 182
ALA A 190
ILE A 209
 None
 0.86A 5xiwB-4e3wA:
undetectable		 5xiwB-4e3wA:
12.57
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.
4e51 HISTIDINE--TRNA
LIGASE

(Burkholderia
thailandensis) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		5 LEU A 140
ALA A 308
LEU A 297
ILE A 100
ALA A  99
 None
 0.83A 5xiwB-4e51A:
undetectable		 5xiwB-4e51A:
12.33
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.
4fho INTERNALIN C2

(Listeria
monocytogenes) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6) 		5 LEU A 103
LEU A  53
ILE A  78
LYS A  58
ALA A  60
 None
 0.95A 5xiwB-4fhoA:
undetectable		 5xiwB-4fhoA:
16.51
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.
4flx DNA POLYMERASE 1

(Pyrococcus
abyssi) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 LEU A 220
LEU A 232
ILE A 191
LYS A 229
ALA A 223
 LEU  A 220 ( 0.6A)
LEU  A 232 ( 0.5A)
ILE  A 191 ( 0.7A)
LYS  A 229 ( 0.0A)
ALA  A 223 ( 0.0A)
 1.00A 5xiwB-4flxA:
undetectable		 5xiwB-4flxA:
8.14
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.
4fmt CHPT PROTEIN

(Caulobacter
vibrioides) 		PF10090
(HPTransfase) 		5 LEU A 112
ALA A 101
ALA A 161
ALA A 146
ILE A 219
 None
 1.00A 5xiwB-4fmtA:
undetectable		 5xiwB-4fmtA:
16.07
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.
4gyi RIO2 KINASE

(Chaetomium
thermophilum) 		PF01163
(RIO1)
PF09202
(Rio2_N) 		5 LEU A  76
LEU A  57
ALA A  41
ILE A  37
ILE A  40
 None
 0.98A 5xiwB-4gyiA:
undetectable		 5xiwB-4gyiA:
15.86
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.
4hb9 SIMILARITIES WITH
PROBABLE
MONOOXYGENASE

(Photorhabdus
laumondii) 		PF01494
(FAD_binding_3) 		5 LEU A 117
LEU A  54
ILE A 108
ALA A  69
ILE A  46
 None
 0.88A 5xiwB-4hb9A:
undetectable		 5xiwB-4hb9A:
10.23
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.
4jx8 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH] FABI

(Escherichia
coli) 		PF13561
(adh_short_C2) 		5 LEU A 144
THR A  12
ALA A  21
ILE A 222
ILE A  24
 NAD  A 302 (-3.9A)
None
None
None
None
 0.87A 5xiwB-4jx8A:
6.6		 5xiwB-4jx8A:
14.49
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.
4kpn NUCLEOSIDE
N-RIBOHYDROLASE 1

(Physcomitrella
patens) 		PF01156
(IU_nuc_hydro) 		5 LEU A  38
ALA A  71
LEU A  67
THR A  50
ALA A  37
 None
 0.88A 5xiwB-4kpnA:
5.4		 5xiwB-4kpnA:
14.49
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.
4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN

(Rhodopirellula
baltica) 		PF13458
(Peripla_BP_6) 		5 LEU A  92
LEU A  94
LEU A 346
ALA A 121
ILE A 362
 None
 0.98A 5xiwB-4kv7A:
undetectable		 5xiwB-4kv7A:
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.
4lhq CAMELID NANOBODY

(Vicugna pacos) 		PF07686
(V-set) 		5 CYH B  22
LEU B   4
ALA B  24
ASN B  32
ILE B  51
 None
 0.83A 5xiwB-4lhqB:
undetectable		 5xiwB-4lhqB:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m87 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Neisseria
meningitidis) 		PF13561
(adh_short_C2) 		5 LEU A 145
THR A  12
ALA A  21
ILE A 223
ILE A  24
 NAD  A 301 (-3.9A)
None
None
None
None
 0.93A 5xiwB-4m87A:
7.0		 5xiwB-4m87A:
15.42
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.
4nez ENGINEERED PROTEIN
OR276

(synthetic
construct) 		no annotation 6 LEU A 126
LEU A 148
ALA A 102
ILE A  89
ALA A 145
ILE A 130
 None
 1.42A 5xiwB-4nezA:
undetectable		 5xiwB-4nezA:
21.95
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.
4ol9 PUTATIVE
2-DEHYDROPANTOATE
2-REDUCTASE

(Mycobacterium
tuberculosis) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		5 ALA A 154
LEU A 156
ILE A  70
ALA A  96
ILE A   5
 None
 0.97A 5xiwB-4ol9A:
undetectable		 5xiwB-4ol9A:
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.
4pqi IN2-1 FAMILY
PROTEIN, GLUTATHIONE
TRANSFERASE LAMBDA3

(Populus
trichocarpa) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 ALA A   4
ILE A  49
LYS A 222
ALA A 220
ILE A 183
 None
 1.02A 5xiwB-4pqiA:
undetectable		 5xiwB-4pqiA:
14.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4twi NAD-DEPENDENT
PROTEIN DEACYLASE 1

(Archaeoglobus
fulgidus) 		PF02146
(SIR2) 		5 LEU A  95
ALA A 184
ILE A 182
ALA A  17
ILE A 210
 None
 0.99A 5xiwB-4twiA:
undetectable		 5xiwB-4twiA:
16.60
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.
4u09 LIC12759

(Leptospira
interrogans) 		PF13855
(LRR_8) 		5 LEU A 268
LEU A 273
ASN A 277
THR A 233
ILE A 244
 None
 0.97A 5xiwB-4u09A:
undetectable		 5xiwB-4u09A:
11.22
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.
4u1r ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E, PLATELET TYPE

(Homo sapiens) 		PF00365
(PFK) 		5 LEU A 636
LEU A 556
ALA A 597
ALA A 600
ILE A 320
 None
 1.01A 5xiwB-4u1rA:
undetectable		 5xiwB-4u1rA:
7.36
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.
4u3t PENICILLIN-BINDING
PROTEIN 2

(Neisseria
gonorrhoeae) 		PF00905
(Transpeptidase) 		5 LEU A 431
THR A 534
ALA A 532
ILE A 530
ILE A 519
 None
 0.90A 5xiwB-4u3tA:
undetectable		 5xiwB-4u3tA:
15.26
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.
4u3t PENICILLIN-BINDING
PROTEIN 2

(Neisseria
gonorrhoeae) 		PF00905
(Transpeptidase) 		5 LEU A 447
THR A 534
ALA A 532
ILE A 530
ILE A 519
 None
 0.85A 5xiwB-4u3tA:
undetectable		 5xiwB-4u3tA:
15.26
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.
4v0p MELANOMA-ASSOCIATED
ANTIGEN 3

(Homo sapiens) 		PF01454
(MAGE) 		5 LEU A 202
ALA A 277
LEU A 256
ALA A 210
ILE A 221
 None
 1.01A 5xiwB-4v0pA:
undetectable		 5xiwB-4v0pA:
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.
4zpx ATP-DEPENDENT
PROTEASE LON

(Thermococcus
onnurineus) 		PF01078
(Mg_chelatase)
PF13654
(AAA_32) 		5 LEU A 208
ALA A 261
LEU A 258
ALA A 237
ILE A 244
 None
 0.90A 5xiwB-4zpxA:
undetectable		 5xiwB-4zpxA:
14.04
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.
4ztk CELL DIVISION
PROTEIN
FTSI/PENICILLIN
BINDING PROTEIN 2

(Legionella
pneumophila) 		PF00905
(Transpeptidase) 		5 LEU A 447
THR A 569
ILE A 542
LYS A 403
ALA A 407
 None
NHE  A 901 (-3.6A)
None
None
None
 0.92A 5xiwB-4ztkA:
undetectable		 5xiwB-4ztkA:
16.44
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.
5dgt BENZOYLFORMATE
DECARBOXYLASE

(Pseudomonas
putida) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		6 LEU A 373
LEU A 407
ALA A 441
ILE A  53
ALA A 437
ILE A 446
 None
 1.28A 5xiwB-5dgtA:
undetectable		 5xiwB-5dgtA:
10.29
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.
5e1v POLYKETIDE SYNTHASE
PKSL

(Bacillus
subtilis) 		no annotation 5 LEU B  62
ALA B  94
ILE B  92
ALA B 114
ILE B  80
 None
 1.01A 5xiwB-5e1vB:
undetectable		 5xiwB-5e1vB:
15.59
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.
5ey2 GTP-SENSING
TRANSCRIPTIONAL
PLEIOTROPIC
REPRESSOR CODY

(Bacillus cereus) 		PF06018
(CodY)
PF08222
(HTH_CodY) 		6 LEU A 221
ASN A 219
ALA A 186
ILE A 206
ALA A 207
ILE A 190
 None
 1.25A 5xiwB-5ey2A:
undetectable		 5xiwB-5ey2A:
17.23
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.
5jbg LGP2

(Gallus gallus) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		5 CYH A 102
LEU A  53
ALA A  51
ALA A 110
ILE A 106
 None
None
None
None
C  X  24 ( 4.4A)
 1.00A 5xiwB-5jbgA:
undetectable		 5xiwB-5jbgA:
8.64
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.
5jjh 4-ALPHA-GLUCANOTRANS
FERASE

(Corynebacterium
glutamicum) 		PF02446
(Glyco_hydro_77) 		5 LEU A 387
LEU A 451
LEU A 494
ALA A 503
ILE A 526
 None
 1.01A 5xiwB-5jjhA:
undetectable		 5xiwB-5jjhA:
7.80
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.
5ksh PENICILLIN-BINDING
PROTEIN 2

(Neisseria
gonorrhoeae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		5 LEU A 447
THR A 534
ALA A 532
ILE A 530
ILE A 519
 None
 0.80A 5xiwB-5kshA:
undetectable		 5xiwB-5kshA:
9.26
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.
5n3u PHYCOCYANOBILIN
LYASE SUBUNIT ALPHA

(Nostoc sp. PCC
7120) 		no annotation 5 LEU A  84
ALA A  80
LEU A  41
ALA A  58
ILE A  23
 None
 1.01A 5xiwB-5n3uA:
undetectable		 5xiwB-5n3uA:
25.53
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.
5nz7 CELLODEXTRIN
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 LEU A 838
ALA A 829
ILE A 845
ALA A 846
ILE A 774
 None
 0.96A 5xiwB-5nz7A:
2.2		 5xiwB-5nz7A:
6.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o6b ATP-DEPENDENT DNA
HELICASE PIF1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A 373
ALA A 401
ILE A 343
ALA A 396
ILE A 302
 None
 0.97A 5xiwB-5o6bA:
undetectable		 5xiwB-5o6bA:
29.63