SIMILAR PATTERNS OF AMINO ACIDS FOR 4G1B_C_ECNC403_1

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c9l CLATHRIN

(Rattus
norvegicus) 		PF01394
(Clathrin_propel)
PF09268
(Clathrin-link) 		5 ILE A  53
GLN A  16
LEU A  15
VAL A 324
LEU A  30
 None
 1.26A 4g1bC-1c9lA:
undetectable		 4g1bC-1c9lA:
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.
1dly HEMOGLOBIN

(Chlamydomonas
moewusii) 		PF01152
(Bac_globin) 		5 PHE A  19
TYR A  20
LEU A  49
VAL A  83
LEU A  87
 None
CYN  A 122 (-4.3A)
None
HEM  A 144 (-4.3A)
None
 1.11A 4g1bC-1dlyA:
3.7		 4g1bC-1dlyA:
18.25
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.
1dml DNA POLYMERASE
PROCESSIVITY FACTOR

(Human
alphaherpesvirus
1) 		PF02282
(Herpes_UL42) 		5 ILE A  72
GLN A 282
LEU A 281
VAL A 309
LEU A  54
 None
 1.17A 4g1bC-1dmlA:
undetectable		 4g1bC-1dmlA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e4o MALTODEXTRIN
PHOSPHORYLASE

(Escherichia
coli) 		PF00343
(Phosphorylase) 		5 ILE A 314
THR A 311
LEU A 409
VAL A 398
VAL A 360
 None
 1.13A 4g1bC-1e4oA:
4.7		 4g1bC-1e4oA:
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.
1fxj UDP-N-ACETYLGLUCOSAM
INE
PYROPHOSPHORYLASE

(Escherichia
coli) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 ILE A 109
GLN A 115
LEU A 114
VAL A 215
LEU A 129
 ILE  A 109 ( 0.4A)
GLN  A 115 ( 0.6A)
LEU  A 114 ( 0.6A)
VAL  A 215 ( 0.6A)
LEU  A 129 ( 0.6A)
 1.22A 4g1bC-1fxjA:
2.9		 4g1bC-1fxjA:
23.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gvh FLAVOHEMOPROTEIN

(Escherichia
coli) 		PF00042
(Globin)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 THR A  25
PHE A  28
TYR A  29
VAL A  98
LEU A 102
 None
None
None
HEM  A1398 (-4.5A)
None
 0.44A 4g1bC-1gvhA:
43.3		 4g1bC-1gvhA:
36.30
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.
1hzv NITRITE REDUCTASE

(Pseudomonas
aeruginosa) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		5 ILE A 205
GLN A 141
LEU A 207
VAL A 172
LEU A 163
 None
 0.97A 4g1bC-1hzvA:
undetectable		 4g1bC-1hzvA:
22.46
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.
1leh LEUCINE
DEHYDROGENASE

(Lysinibacillus
sphaericus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 ILE A   3
GLN A  14
LEU A  15
VAL A  28
LEU A  59
 None
 1.16A 4g1bC-1lehA:
5.1		 4g1bC-1lehA:
19.55
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.
1mc0 3',5'-CYCLIC
NUCLEOTIDE
PHOSPHODIESTERASE 2A

(Mus musculus) 		PF01590
(GAF)
PF13185
(GAF_2) 		5 ILE A 500
LEU A 407
VAL A 403
VAL A 434
LEU A 427
 None
 1.23A 4g1bC-1mc0A:
2.1		 4g1bC-1mc0A:
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.
1no5 HYPOTHETICAL PROTEIN
HI0073

(Haemophilus
influenzae) 		PF01909
(NTP_transf_2) 		5 ILE A 101
LEU A  49
VAL A  78
VAL A  25
LEU A  21
 None
 1.13A 4g1bC-1no5A:
undetectable		 4g1bC-1no5A:
16.94
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.
1q51 MENB

(Mycobacterium
tuberculosis) 		PF00378
(ECH_1) 		5 TYR A  39
LEU A  69
VAL A 139
VAL A  85
LEU A  87
 None
 1.18A 4g1bC-1q51A:
2.4		 4g1bC-1q51A:
22.07
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.
1qox BETA-GLUCOSIDASE

(Bacillus
circulans) 		PF00232
(Glyco_hydro_1) 		5 GLN A  66
LEU A  68
VAL A  73
VAL A 421
LEU A 404
 None
 1.19A 4g1bC-1qoxA:
undetectable		 4g1bC-1qoxA:
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.
1smk MALATE
DEHYDROGENASE,
GLYOXYSOMAL

(Citrullus
lanatus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A  88
THR A  85
LEU A  75
VAL A  72
LEU A  73
 None
 1.09A 4g1bC-1smkA:
2.0		 4g1bC-1smkA:
21.71
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.
1ssq SERINE
ACETYLTRANSFERASE

(Haemophilus
influenzae) 		PF00132
(Hexapep)
PF06426
(SATase_N) 		5 ILE A 112
THR A 113
GLN A 129
LEU A 128
LEU A 124
 None
 1.21A 4g1bC-1ssqA:
undetectable		 4g1bC-1ssqA:
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.
1uvx GLOBIN LI637

(Chlamydomonas
moewusii) 		PF01152
(Bac_globin) 		5 PHE A  19
TYR A  20
LEU A  49
VAL A  83
LEU A  87
 XE  A1126 ( 4.2A)
CYN  A1123 (-4.9A)
XE  A1125 (-4.7A)
HEM  A1122 (-4.5A)
XE  A1126 (-3.7A)
 1.12A 4g1bC-1uvxA:
3.6		 4g1bC-1uvxA:
14.00
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.
1xmx HYPOTHETICAL PROTEIN
VC1899

(Vibrio cholerae) 		PF09002
(DUF1887) 		5 THR A 309
PHE A 342
LEU A 252
VAL A 256
LEU A 366
 None
 1.18A 4g1bC-1xmxA:
5.2		 4g1bC-1xmxA:
22.99
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.
1z7c CHORIONIC
SOMATOMAMMOTROPIN
HORMONE

(Homo sapiens) 		PF00103
(Hormone_1) 		5 ILE A 121
GLN A 181
LEU A 177
VAL A 173
LEU A 117
 None
 1.24A 4g1bC-1z7cA:
2.7		 4g1bC-1z7cA:
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.
2czq CUTINASE-LIKE
PROTEIN

(Cryptococcus
sp. S-2) 		PF01083
(Cutinase) 		5 ILE A  63
LEU A  81
VAL A 108
VAL A 149
LEU A  95
 None
 1.00A 4g1bC-2czqA:
3.0		 4g1bC-2czqA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dzi UBIQUITIN-LIKE
PROTEIN 4A

(Homo sapiens) 		PF00240
(ubiquitin) 		5 ILE A  68
LEU A  63
VAL A  30
VAL A  12
LEU A  74
 None
 1.26A 4g1bC-2dziA:
undetectable		 4g1bC-2dziA:
12.22
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.
2gu1 ZINC PEPTIDASE

(Vibrio cholerae) 		PF01551
(Peptidase_M23)
PF04225
(OapA) 		5 ILE A  35
TYR A  89
GLN A  44
LEU A  45
LEU A  67
 None
 1.19A 4g1bC-2gu1A:
undetectable		 4g1bC-2gu1A:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i4s GENERAL SECRETION
PATHWAY PROTEIN C

(Vibrio cholerae) 		no annotation 5 ILE A 253
GLN A 256
LEU A 255
VAL A 241
LEU A 290
 None
 1.17A 4g1bC-2i4sA:
undetectable		 4g1bC-2i4sA:
12.53
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.
2inc TOUB PROTEIN

(Pseudomonas
stutzeri) 		PF06234
(TmoB) 		5 ILE C   6
THR C  78
LEU C  79
VAL C  53
LEU C  73
 None
 1.21A 4g1bC-2incC:
undetectable		 4g1bC-2incC:
11.17
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.
2iop CHAPERONE PROTEIN
HTPG

(Escherichia
coli) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		5 THR A 345
GLN A 340
LEU A 339
VAL A 334
LEU A 299
 None
 1.19A 4g1bC-2iopA:
undetectable		 4g1bC-2iopA:
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.
2it1 362AA LONG
HYPOTHETICAL
MALTOSE/MALTODEXTRIN
TRANSPORT
ATP-BINDING PROTEIN

(Pyrococcus
horikoshii) 		PF00005
(ABC_tran) 		5 ILE A 279
GLN A 264
LEU A 346
VAL A 341
LEU A 259
 None
 0.90A 4g1bC-2it1A:
undetectable		 4g1bC-2it1A:
20.80
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.
2jzn MANNOSE-SPECIFIC
PHOSPHOTRANSFERASE
ENZYME IIA COMPONENT

(Escherichia
coli) 		PF03610
(EIIA-man) 		5 ILE A   5
PHE A  64
TYR A  49
LEU A  65
VAL A  81
 None
 1.22A 4g1bC-2jznA:
undetectable		 4g1bC-2jznA:
15.63
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.
2npn PUTATIVE COBALAMIN
SYNTHESIS RELATED
PROTEIN

(Corynebacterium
diphtheriae) 		PF00590
(TP_methylase) 		5 ILE A 121
THR A 118
LEU A  34
VAL A  63
LEU A  90
 None
 1.08A 4g1bC-2npnA:
2.1		 4g1bC-2npnA:
22.91
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.
2oi6 BIFUNCTIONAL PROTEIN
GLMU

(Escherichia
coli) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 ILE A 109
GLN A 115
LEU A 114
VAL A 215
LEU A 129
 None
 1.22A 4g1bC-2oi6A:
2.7		 4g1bC-2oi6A:
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.
2oz4 INTERCELLULAR
ADHESION MOLECULE 1

(Homo sapiens) 		no annotation 5 THR A 274
LEU A 194
VAL A 208
VAL A 223
LEU A 225
 None
 1.02A 4g1bC-2oz4A:
undetectable		 4g1bC-2oz4A:
22.71
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.
2vvg KINESIN-2

(Giardia
intestinalis) 		PF00225
(Kinesin) 		5 ILE A  82
LEU A 237
VAL A 218
VAL A 240
LEU A 239
 None
 1.16A 4g1bC-2vvgA:
undetectable		 4g1bC-2vvgA:
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.
2wy4 SINGLE DOMAIN
HAEMOGLOBIN

(Campylobacter
jejuni) 		PF00042
(Globin) 		6 THR A  24
PHE A  27
TYR A  28
GLN A  52
VAL A  97
LEU A 101
 None
None
CYN  A 151 (-4.7A)
HEM  A 150 ( 3.6A)
HEM  A 150 (-4.5A)
None
 0.92A 4g1bC-2wy4A:
20.8		 4g1bC-2wy4A:
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.
2wy4 SINGLE DOMAIN
HAEMOGLOBIN

(Campylobacter
jejuni) 		PF00042
(Globin) 		6 THR A  24
PHE A  27
TYR A  28
LEU A  23
VAL A  97
LEU A 101
 None
None
CYN  A 151 (-4.7A)
None
HEM  A 150 (-4.5A)
None
 1.44A 4g1bC-2wy4A:
20.8		 4g1bC-2wy4A:
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.
2x8x TLR1789 PROTEIN

(Thermosynechococcus
elongatus) 		PF07244
(POTRA)
PF08479
(POTRA_2) 		5 ILE X 164
PHE X 188
VAL X 199
VAL X 155
LEU X 156
 None
 1.23A 4g1bC-2x8xX:
undetectable		 4g1bC-2x8xX:
21.81
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.
2z00 DIHYDROOROTASE

(Thermus
thermophilus) 		PF01979
(Amidohydro_1) 		5 THR A 122
GLN A 125
LEU A 121
VAL A 171
LEU A 157
 None
 1.18A 4g1bC-2z00A:
undetectable		 4g1bC-2z00A:
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.
3a0j COLD SHOCK PROTEIN

(Thermus
thermophilus) 		PF00313
(CSD) 		5 ILE A  33
THR A  40
PHE A  38
LEU A  41
VAL A   6
 None
 1.23A 4g1bC-3a0jA:
undetectable		 4g1bC-3a0jA:
11.81
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.
3a9s D-ARABINOSE
ISOMERASE

(Aeribacillus
pallidus) 		PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2) 		5 ILE A 143
PHE A 167
LEU A 164
VAL A  42
VAL A  87
 None
 1.12A 4g1bC-3a9sA:
4.7		 4g1bC-3a9sA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b83 TEN-D3

(Homo sapiens) 		PF00041
(fn3) 		5 ILE A  53
LEU A  49
VAL A  47
VAL A  19
LEU A  56
 None
 1.11A 4g1bC-3b83A:
undetectable		 4g1bC-3b83A:
13.47
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.
3b9y AMMONIUM TRANSPORTER
FAMILY RH-LIKE
PROTEIN

(Nitrosomonas
europaea) 		PF00909
(Ammonium_transp) 		5 ILE A 368
LEU A 126
VAL A 122
VAL A  76
LEU A 134
 None
 1.05A 4g1bC-3b9yA:
undetectable		 4g1bC-3b9yA:
25.39
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.
3bjx HALOCARBOXYLIC ACID
DEHALOGENASE DEHI

(Pseudomonas
putida) 		PF10778
(DehI) 		5 ILE A 279
THR A 280
LEU A 107
VAL A 103
LEU A  86
 None
 1.22A 4g1bC-3bjxA:
undetectable		 4g1bC-3bjxA:
21.27
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.
3blw ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF00180
(Iso_dh) 		5 ILE A 123
PHE A 110
LEU A 250
VAL A 127
LEU A 125
 None
 1.25A 4g1bC-3blwA:
2.3		 4g1bC-3blwA:
23.13
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.
3bo6 HYDROPHILIC PROTEIN,
VIRA PROTEIN

(Chromobacterium
violaceum) 		PF03536
(VRP3) 		5 ILE A 107
PHE A 105
LEU A 183
VAL A 159
LEU A 157
 None
 1.12A 4g1bC-3bo6A:
undetectable		 4g1bC-3bo6A:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3c9p UNCHARACTERIZED
PROTEIN SP1917

(Streptococcus
pneumoniae) 		PF09966
(DUF2200) 		5 PHE A  10
TYR A  56
LEU A  15
VAL A  46
LEU A  50
 None
EDO  A 201 (-4.4A)
None
None
None
 1.15A 4g1bC-3c9pA:
undetectable		 4g1bC-3c9pA:
16.28
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.
3csk PROBABLE
DIPEPTIDYL-PEPTIDASE
3

(Saccharomyces
cerevisiae) 		PF03571
(Peptidase_M49) 		5 ILE A 612
PHE A 436
LEU A 601
VAL A 667
LEU A 561
 None
 1.22A 4g1bC-3cskA:
undetectable		 4g1bC-3cskA:
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.
3cwx PROTEIN CAGD

(Helicobacter
pylori) 		PF16567
(CagD) 		5 ILE A 166
PHE A 167
TYR A 168
LEU A 163
LEU A 122
 None
 1.21A 4g1bC-3cwxA:
undetectable		 4g1bC-3cwxA:
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.
3fww BIFUNCTIONAL PROTEIN
GLMU

(Yersinia pestis) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 ILE A 109
GLN A 115
LEU A 114
VAL A 215
LEU A 129
 None
 1.21A 4g1bC-3fwwA:
2.2		 4g1bC-3fwwA:
22.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3guv SITE-SPECIFIC
RECOMBINASE,
RESOLVASE FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF00239
(Resolvase) 		5 ILE A 116
LEU A  85
VAL A  95
VAL A  80
LEU A 109
 None
 1.10A 4g1bC-3guvA:
undetectable		 4g1bC-3guvA:
19.95
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.
3kfu GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Thermus
thermophilus) 		PF01425
(Amidase) 		5 GLN E 436
LEU E 383
VAL E 249
VAL E 261
LEU E 265
 None
 1.02A 4g1bC-3kfuE:
undetectable		 4g1bC-3kfuE:
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.
3lmd GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE

(Corynebacterium
glutamicum) 		PF00348
(polyprenyl_synt) 		5 ILE A  38
THR A  35
LEU A  34
VAL A 334
VAL A  27
 None
 1.21A 4g1bC-3lmdA:
undetectable		 4g1bC-3lmdA:
24.39
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.
3lno PUTATIVE
UNCHARACTERIZED
PROTEIN

(Bacillus
anthracis) 		PF01883
(FeS_assembly_P) 		5 ILE A  45
LEU A  14
VAL A  17
VAL A  72
LEU A  68
 None
 1.22A 4g1bC-3lnoA:
undetectable		 4g1bC-3lnoA:
14.66
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.
3ntd FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Shewanella
loihica) 		PF00581
(Rhodanese)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ILE A 457
GLN A 440
LEU A 439
VAL A 378
LEU A 399
 None
 1.14A 4g1bC-3ntdA:
5.2		 4g1bC-3ntdA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oqh PUTATIVE
UNCHARACTERIZED
PROTEIN YVMC

(Bacillus
licheniformis) 		PF16715
(CDPS) 		5 ILE A 214
PHE A 188
TYR A 229
LEU A 210
LEU A 185
 None
 1.19A 4g1bC-3oqhA:
2.5		 4g1bC-3oqhA:
23.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ozv FLAVOHEMOGLOBIN

(Cupriavidus
necator) 		no annotation 5 ILE B  24
PHE B  28
TYR B  29
GLN B  53
VAL B  61
 ECN  B 411 (-3.5A)
ECN  B 411 (-4.0A)
None
HEM  B 404 (-3.9A)
DGG  B 406 ( 4.8A)
 1.00A 4g1bC-3ozvB:
45.3		 4g1bC-3ozvB:
37.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ozv FLAVOHEMOGLOBIN

(Cupriavidus
necator) 		no annotation 6 ILE B  24
PHE B  28
TYR B  29
GLN B  53
VAL B  98
LEU B 102
 ECN  B 411 (-3.5A)
ECN  B 411 (-4.0A)
None
HEM  B 404 (-3.9A)
HEM  B 404 ( 4.5A)
ECN  B 411 (-3.2A)
 0.77A 4g1bC-3ozvB:
45.3		 4g1bC-3ozvB:
37.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ozv FLAVOHEMOGLOBIN

(Cupriavidus
necator) 		no annotation 5 ILE B  24
TYR B  29
GLN B  53
LEU B  57
VAL B  61
 ECN  B 411 (-3.5A)
None
HEM  B 404 (-3.9A)
ECN  B 411 (-4.1A)
DGG  B 406 ( 4.8A)
 1.21A 4g1bC-3ozvB:
45.3		 4g1bC-3ozvB:
37.95
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.
3pco PHENYLALANYL-TRNA
SYNTHETASE, BETA
CHAIN

(Escherichia
coli) 		PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		5 ILE B 524
LEU B 669
VAL B 665
VAL B 557
LEU B 553
 None
 1.22A 4g1bC-3pcoB:
undetectable		 4g1bC-3pcoB:
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.
3qj4 RENALASE

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF13450
(NAD_binding_8) 		5 ILE A 173
GLN A 168
LEU A 169
VAL A 132
LEU A 159
 None
None
None
FAD  A 401 (-4.1A)
None
 1.03A 4g1bC-3qj4A:
4.4		 4g1bC-3qj4A:
21.27
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.
3rcn BETA-N-ACETYLHEXOSAM
INIDASE

(Paenarthrobacter
aurescens) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b) 		5 THR A 359
LEU A 309
VAL A 243
VAL A 298
LEU A 295
 None
 1.24A 4g1bC-3rcnA:
undetectable		 4g1bC-3rcnA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3thn EXONUCLEASE,
PUTATIVE

(Thermotoga
maritima) 		PF00149
(Metallophos) 		5 ILE A 176
LEU A  54
VAL A  88
VAL A  50
LEU A  52
 None
 1.12A 4g1bC-3thnA:
undetectable		 4g1bC-3thnA:
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.
3tho EXONUCLEASE,
PUTATIVE

(Thermotoga
maritima) 		PF00149
(Metallophos) 		5 ILE B 176
LEU B  54
VAL B  88
VAL B  50
LEU B  52
 None
 1.10A 4g1bC-3thoB:
undetectable		 4g1bC-3thoB:
23.93
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.
3tm9 BACTERIAL HEMOGLOBIN

(Vitreoscilla
stercoraria) 		PF00042
(Globin) 		5 ILE A  24
THR A  25
PHE A  28
VAL A  98
LEU A 102
 None
None
None
HEM  A 201 (-3.5A)
None
 0.65A 4g1bC-3tm9A:
19.9		 4g1bC-3tm9A:
20.88
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.
3tqe MALONYL-COA-[ACYL-CA
RRIER-PROTEIN]
TRANSACYLASE

(Coxiella
burnetii) 		PF00698
(Acyl_transf_1) 		5 THR A  33
PHE A  34
VAL A 112
VAL A  49
LEU A  45
 None
 1.06A 4g1bC-3tqeA:
undetectable		 4g1bC-3tqeA:
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.
3wd7 TYPE III POLYKETIDE
SYNTHASES ACRIDONE
SYNTHASE

(Citrus x
microcarpa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ILE A 148
THR A 145
LEU A 144
VAL A 186
LEU A 187
 ILE  A 148 ( 0.7A)
THR  A 145 ( 0.8A)
LEU  A 144 ( 0.5A)
VAL  A 186 ( 0.6A)
LEU  A 187 ( 0.5A)
 1.13A 4g1bC-3wd7A:
undetectable		 4g1bC-3wd7A:
23.06
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.
4aj9 CATALASE-3

(Neurospora
crassa) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 ILE A 121
LEU A 314
VAL A 263
VAL A 343
LEU A 344
 None
 1.26A 4g1bC-4aj9A:
2.4		 4g1bC-4aj9A:
20.94
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.
4djf CORRINOID/IRON-SULFU
R PROTEIN LARGE
SUBUNIT

(Moorella
thermoacetica) 		PF03599
(CdhD)
PF04060
(FeS) 		5 ILE C  94
TYR C 126
GLN C 309
VAL C 284
LEU C 304
 None
 1.18A 4g1bC-4djfC:
2.3		 4g1bC-4djfC:
22.77
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.
4fff LEVAN
FRUCTOTRANSFERASE

(Paenarthrobacter
ureafaciens) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		5 ILE A 235
TYR A 269
VAL A 201
VAL A 253
LEU A 254
 None
 1.25A 4g1bC-4fffA:
undetectable		 4g1bC-4fffA:
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.
4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1

(Staphylococcus
aureus) 		PF01497
(Peripla_BP_2) 		5 PHE A 208
LEU A 297
VAL A 271
VAL A 203
LEU A 204
 None
MLY  A 296 ( 4.3A)
MLY  A 272 ( 3.1A)
None
None
 1.10A 4g1bC-4fkmA:
3.8		 4g1bC-4fkmA:
21.04
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.
4jpk GERMLINE-TARGETING
HIV-1 GP120
ENGINEERED OUTER
DOMAIN, EOD-GT6

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		5 ILE A  19
THR A  20
PHE A  63
GLN A  90
LEU A  91
 None
 1.26A 4g1bC-4jpkA:
undetectable		 4g1bC-4jpkA:
17.59
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.
4jpk GERMLINE-TARGETING
HIV-1 GP120
ENGINEERED OUTER
DOMAIN, EOD-GT6

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		5 ILE A  19
THR A  20
PHE A  63
LEU A  91
LEU A  22
 None
 1.04A 4g1bC-4jpkA:
undetectable		 4g1bC-4jpkA:
17.59
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.
4k6j WINGS APART-LIKE
PROTEIN HOMOLOG

(Homo sapiens) 		PF07814
(WAPL) 		5 ILE A 658
TYR A 660
LEU A 662
VAL A 703
LEU A 681
 None
 1.22A 4g1bC-4k6jA:
undetectable		 4g1bC-4k6jA:
21.39
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.
4l9a PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.1393C

(Streptococcus
mutans) 		no annotation 5 ILE A 216
PHE A 121
TYR A 235
VAL A  99
LEU A  97
 None
 1.07A 4g1bC-4l9aA:
3.0		 4g1bC-4l9aA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lej VICILIN

(Pinus
koraiensis) 		PF00190
(Cupin_1) 		5 THR A 285
PHE A 304
LEU A 270
VAL A 155
LEU A 394
 None
 1.06A 4g1bC-4lejA:
undetectable		 4g1bC-4lejA:
22.73
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.
4n0l PREDICTED COMPONENT
OF A
THERMOPHILE-SPECIFIC
DNA REPAIR SYSTEM,
CONTAINS A RAMP
DOMAIN

(Methanopyrus
kandleri) 		PF03787
(RAMPs) 		5 ILE A 272
LEU A 226
VAL A 228
VAL A 252
LEU A 249
 None
 1.10A 4g1bC-4n0lA:
undetectable		 4g1bC-4n0lA:
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.
4n0n REPLICASE
POLYPROTEIN 1AB

(Equine
arteritis virus) 		PF01443
(Viral_helicase1) 		5 ILE A 223
LEU A 196
VAL A 169
VAL A 183
LEU A 181
 SO4  A 504 (-3.8A)
None
None
None
None
 1.24A 4g1bC-4n0nA:
undetectable		 4g1bC-4n0nA:
22.68
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.
4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1

(Vibrio cholerae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 ILE A 292
LEU A 298
VAL A 314
VAL A 279
LEU A 283
 None
 1.19A 4g1bC-4nhdA:
undetectable		 4g1bC-4nhdA:
25.00
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.
4ny4 CYTOCHROME P450 3A4

(Homo sapiens) 		PF00067
(p450) 		5 PHE A 465
LEU A 321
VAL A 359
VAL A 459
LEU A 460
 None
 1.25A 4g1bC-4ny4A:
undetectable		 4g1bC-4ny4A:
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.
4r04 TOXIN A

(Clostridioides
difficile) 		PF11713
(Peptidase_C80)
PF12918
(TcdB_N)
PF12919
(TcdA_TcdB)
PF12920
(TcdA_TcdB_pore) 		5 ILE A1538
TYR A1565
LEU A1555
VAL A1552
LEU A1586
 None
 1.10A 4g1bC-4r04A:
3.0		 4g1bC-4r04A:
11.74
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.
4wd3 L-AMINO ACID LIGASE

(Bacillus
subtilis) 		PF13535
(ATP-grasp_4) 		5 ILE A 354
PHE A 382
LEU A 380
VAL A 390
LEU A 393
 None
 1.20A 4g1bC-4wd3A:
6.4		 4g1bC-4wd3A:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zkt BOTULINUM NEUROTOXIN
TYPE E,
NONTOXIC-NONHEMAGGLU
TININ COMPONENT,
NTNH

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		5 ILE B1042
LEU B1100
VAL B1081
VAL B1143
LEU B1044
 None
 1.25A 4g1bC-4zktB:
2.4		 4g1bC-4zktB:
15.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c0u ALKYLMERCURY LYASE

(Escherichia
coli) 		PF03243
(MerB)
PF12324
(HTH_15) 		5 PHE A 193
GLN A 134
LEU A 126
VAL A 113
LEU A 101
 None
 1.25A 4g1bC-5c0uA:
undetectable		 4g1bC-5c0uA:
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.
5g56 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase)
PF03422
(CBM_6) 		5 ILE A 511
GLN A 495
LEU A 497
VAL A 459
LEU A 445
 None
 1.19A 4g1bC-5g56A:
2.4		 4g1bC-5g56A:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gk9 HISTONE
ACETYLTRANSFERASE
KAT7

(Homo sapiens) 		PF01853
(MOZ_SAS) 		5 ILE A 555
GLN A 560
LEU A 559
VAL A 574
LEU A 527
 None
 1.20A 4g1bC-5gk9A:
undetectable		 4g1bC-5gk9A:
20.05
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.
5hh3 OXYA PROTEIN

(Actinoplanes
teichomyceticus) 		PF00067
(p450) 		5 ILE A 356
PHE A 352
VAL A 120
VAL A 237
LEU A 241
 None
 1.09A 4g1bC-5hh3A:
undetectable		 4g1bC-5hh3A:
22.71
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.
5hvd ION TRANSPORT
PROTEIN

(Magnetococcus
marinus) 		PF00520
(Ion_trans) 		5 ILE A  55
GLN A  50
LEU A  51
VAL A  28
LEU A  24
 None
 1.14A 4g1bC-5hvdA:
3.6		 4g1bC-5hvdA:
19.66
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.
5j6s ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 2

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		5 ILE A 316
TYR A 318
GLN A 375
VAL A 381
VAL A 257
 None
None
None
None
NAG  A1004 (-3.8A)
 1.20A 4g1bC-5j6sA:
3.7		 4g1bC-5j6sA:
17.85
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.
5kin TRYPTOPHAN SYNTHASE
ALPHA CHAIN

(Streptococcus
pneumoniae) 		PF00290
(Trp_syntA) 		5 ILE A 128
THR A 101
LEU A 106
VAL A 111
VAL A 123
 GOL  A 301 (-4.5A)
None
None
None
None
 0.91A 4g1bC-5kinA:
undetectable		 4g1bC-5kinA:
23.51
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.
5la0 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase)
PF03422
(CBM_6) 		5 ILE A 511
GLN A 495
LEU A 497
VAL A 459
LEU A 445
 None
 1.17A 4g1bC-5la0A:
2.0		 4g1bC-5la0A:
23.73
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.
5m7o NITROGEN
ASSIMILATION
REGULATORY PROTEIN

(Brucella
abortus) 		PF00072
(Response_reg)
PF00158
(Sigma54_activat)
PF02954
(HTH_8) 		5 ILE A 156
LEU A 152
VAL A 306
VAL A 143
LEU A 142
 None
 1.23A 4g1bC-5m7oA:
2.5		 4g1bC-5m7oA:
22.57
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.
5mnw GUANYLATE CYCLASE
SOLUBLE SUBUNIT
BETA-1

(Homo sapiens) 		no annotation 5 ILE A  66
PHE A  70
LEU A  67
VAL A   5
LEU A   9
 None
None
None
Z90  A 201 (-4.3A)
None
 1.25A 4g1bC-5mnwA:
undetectable		 4g1bC-5mnwA:
11.97
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.
5nlt CVAA9A

(Collariella
virescens) 		no annotation 5 ILE A  87
GLN A 146
LEU A 144
VAL A 175
LEU A 133
 None
 1.00A 4g1bC-5nltA:
undetectable		 4g1bC-5nltA:
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.
5ol0 PUTATIVE SILENT
INFORMATION
REGULATOR 2,PUTATIVE
SILENT INFORMATION
REGULATOR 2

(Leishmania
infantum) 		no annotation 5 ILE A  26
LEU A 211
VAL A 238
VAL A  13
LEU A  14
 None
 1.12A 4g1bC-5ol0A:
4.1		 4g1bC-5ol0A:
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.
5ulu CADHERIN-23

(Mus musculus) 		no annotation 5 ILE A2188
PHE A2208
TYR A2231
GLN A2204
VAL A2219
 None
 1.25A 4g1bC-5uluA:
undetectable		 4g1bC-5uluA:
14.16
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.
5uv2 (+)-LIMONENE
SYNTHASE

(Citrus sinensis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 GLN A 279
LEU A 585
VAL A 581
VAL A 310
LEU A 314
 None
 1.20A 4g1bC-5uv2A:
undetectable		 4g1bC-5uv2A:
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.
5vha DEAH
(ASP-GLU-ALA-HIS)
BOX POLYPEPTIDE 36

(Bos taurus) 		no annotation 5 ILE A 317
THR A 314
LEU A 348
VAL A 352
LEU A 321
 None
 1.18A 4g1bC-5vhaA:
undetectable		 4g1bC-5vhaA:
11.75
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.
5w19 TRYPTOPHANASE

(Proteus
vulgaris) 		no annotation 5 ILE A 417
THR A 416
LEU A  48
VAL A 386
VAL A 357
 None
 1.08A 4g1bC-5w19A:
undetectable		 4g1bC-5w19A:
12.11
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.
5w76 ANCESTRAL ELOGATION
FACTOR N153

(synthetic
construct) 		no annotation 5 TYR A  70
LEU A  28
VAL A 105
VAL A 196
LEU A 192
 None
 1.22A 4g1bC-5w76A:
3.4		 4g1bC-5w76A:
13.52
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.
5ydj ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 5 ILE A 478
THR A 480
TYR A 581
LEU A 384
VAL A 366
 None
 0.92A 4g1bC-5ydjA:
undetectable		 4g1bC-5ydjA:
12.28
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.
6arx ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 5 ILE A 478
THR A 480
TYR A 581
LEU A 384
VAL A 366
 None
 1.01A 4g1bC-6arxA:
undetectable		 4g1bC-6arxA:
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.
6c4u FORKHEAD-ASSOCIATED
1

(Saccharomyces
cerevisiae) 		no annotation 5 THR B  40
LEU B 141
VAL B 132
VAL B 144
LEU B 143
 None
GOL  B 201 (-4.2A)
None
None
None
 1.18A 4g1bC-6c4uB:
undetectable		 4g1bC-6c4uB:
11.95
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.
6f2d FLAGELLAR
BIOSYNTHETIC PROTEIN
FLIP

(Salmonella
enterica) 		no annotation 5 ILE A 189
THR A 188
PHE A 187
GLN A 184
LEU A  73
 None
 1.25A 4g1bC-6f2dA:
undetectable		 4g1bC-6f2dA:
11.62