SIMILAR PATTERNS OF AMINO ACIDS FOR 6DEB_B_MTXB302

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.
1a4i METHYLENETETRAHYDROF
OLATE DEHYDROGENASE
/
METHENYLTETRAHYDROFO
LATE CYCLOHYDROLASE

(Homo sapiens) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		10 LEU A  98
GLN A 100
LEU A 101
PRO A 102
ASP A 125
THR A 148
SER A 174
ILE A 176
VAL A 177
THR A 279
 None
None
None
None
None
NDP  A 302 (-3.6A)
NDP  A 302 (-2.6A)
NDP  A 302 ( 4.9A)
NDP  A 302 (-4.3A)
NDP  A 302 ( 3.7A)
 0.67A 6debB-1a4iA:
41.5		 6debB-1a4iA:
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.
1a4i METHYLENETETRAHYDROF
OLATE DEHYDROGENASE
/
METHENYLTETRAHYDROFO
LATE CYCLOHYDROLASE

(Homo sapiens) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 LEU A  98
GLN A 100
LEU A 101
PRO A 102
ASP A 125
THR A 279
 None
None
None
None
None
NDP  A 302 ( 3.7A)
 1.03A 6debB-1a4iA:
41.5		 6debB-1a4iA:
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.
1b0a PROTEIN (FOLD
BIFUNCTIONAL
PROTEIN)

(Escherichia
coli) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		9 LEU A  96
GLN A  98
ASP A 121
PHE A 123
THR A 142
SER A 168
ILE A 170
VAL A 171
THR A 267
 None
 0.81A 6debB-1b0aA:
40.9		 6debB-1b0aA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b0a PROTEIN (FOLD
BIFUNCTIONAL
PROTEIN)

(Escherichia
coli) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		8 LEU A  96
GLN A  98
LEU A  99
PRO A 100
ASP A 121
PHE A 123
THR A 142
THR A 267
 None
 0.71A 6debB-1b0aA:
40.9		 6debB-1b0aA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b0a PROTEIN (FOLD
BIFUNCTIONAL
PROTEIN)

(Escherichia
coli) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 LEU A  96
GLN A  98
LEU A  99
PRO A 100
ASP A 121
THR A 267
 None
 1.18A 6debB-1b0aA:
40.9		 6debB-1b0aA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b0a PROTEIN (FOLD
BIFUNCTIONAL
PROTEIN)

(Escherichia
coli) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		9 LEU A  96
GLN A  98
PRO A 100
ASP A 121
PHE A 123
THR A 142
ILE A 170
VAL A 171
THR A 267
 None
 0.84A 6debB-1b0aA:
40.9		 6debB-1b0aA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b0a PROTEIN (FOLD
BIFUNCTIONAL
PROTEIN)

(Escherichia
coli) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 LEU A  99
PRO A 100
ASP A 121
PHE A 123
THR A 142
 None
 0.98A 6debB-1b0aA:
40.9		 6debB-1b0aA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1br2 MYOSIN

(Gallus gallus) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		5 GLN A 129
LEU A 130
PRO A 131
ILE A 113
VAL A 123
 ADP  A 998 ( 4.4A)
None
None
None
None
 1.13A 6debB-1br2A:
undetectable		 6debB-1br2A:
7.58
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.
1d0b INTERNALIN B

(Listeria
monocytogenes) 		PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 LEU A  61
LEU A  97
PRO A  98
PHE A  48
THR A  42
 None
 1.25A 6debB-1d0bA:
undetectable		 6debB-1d0bA:
15.87
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.
1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE

(Streptomyces
clavuligerus) 		PF03171
(2OG-FeII_Oxy) 		5 LEU A 215
PRO A 216
PHE A 225
ILE A 192
VAL A 262
 None
None
None
AKG  A 902 ( 4.6A)
AKG  A 902 ( 4.8A)
 1.25A 6debB-1e5iA:
undetectable		 6debB-1e5iA:
13.85
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.
1edz 5,10-METHYLENETETRAH
YDROFOLATE
DEHYDROGENASE

(Saccharomyces
cerevisiae) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 PRO A 100
THR A 151
SER A 186
ILE A 188
VAL A 189
 None
 0.89A 6debB-1edzA:
30.3		 6debB-1edzA:
16.17
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.
1edz 5,10-METHYLENETETRAH
YDROFOLATE
DEHYDROGENASE

(Saccharomyces
cerevisiae) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 PRO A 100
THR A 151
SER A 186
VAL A 189
THR A 299
 None
 0.82A 6debB-1edzA:
30.3		 6debB-1edzA:
16.17
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.
1g7u 2-DEHYDRO-3-DEOXYPHO
SPHOOCTONATE
ALDOLASE

(Escherichia
coli) 		PF00793
(DAHP_synth_1) 		5 LEU A 114
PRO A 115
PHE A 155
THR A 131
ILE A 135
 None
 1.12A 6debB-1g7uA:
undetectable		 6debB-1g7uA:
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.
1goj KINESIN HEAVY CHAIN

(Neurospora
crassa) 		PF00225
(Kinesin) 		5 LEU A 236
LEU A 303
PHE A 323
ILE A 269
THR A 288
 None
 1.22A 6debB-1gojA:
undetectable		 6debB-1gojA:
12.18
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.
1n0w DNA REPAIR PROTEIN
RAD51 HOMOLOG 1

(Homo sapiens) 		PF08423
(Rad51) 		5 LEU A 302
THR A 298
SER A 317
ILE A 314
THR A 123
 None
 0.97A 6debB-1n0wA:
undetectable		 6debB-1n0wA:
17.41
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.
1vp5 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE

(Thermotoga
maritima) 		PF00248
(Aldo_ket_red) 		5 LEU A 251
SER A 206
ILE A 207
VAL A 203
THR A 261
 None
 1.24A 6debB-1vp5A:
undetectable		 6debB-1vp5A:
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.
2c2y METHYLENETETRAHYDROF
OLATE
DEHYDROGENASE-METHEN
YLTETRAHYDROFOLATE
CYCLOHYDROLASE

(Mycobacterium
tuberculosis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLN A  97
ASP A 120
THR A 141
VAL A 170
THR A 266
 None
 0.71A 6debB-2c2yA:
39.6		 6debB-2c2yA:
13.24
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.
2c2y METHYLENETETRAHYDROF
OLATE
DEHYDROGENASE-METHEN
YLTETRAHYDROFOLATE
CYCLOHYDROLASE

(Mycobacterium
tuberculosis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLN A  97
LEU A  98
PRO A  99
ASP A 120
THR A 266
 None
 0.77A 6debB-2c2yA:
39.6		 6debB-2c2yA:
13.24
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.
2i8b MINOR NUCLEOPROTEIN
VP30

(Zaire
ebolavirus) 		PF11507
(Transcript_VP30) 		5 LEU A 249
GLN A 185
LEU A 186
PHE A 242
VAL A 176
 None
 1.28A 6debB-2i8bA:
undetectable		 6debB-2i8bA:
20.75
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.
2p4z METAL-DEPENDENT
HYDROLASES OF THE
BETA-LACTAMASE
SUPERFAMILY II

(Caldanaerobacter
subterraneus) 		PF00753
(Lactamase_B) 		5 LEU A 222
LEU A 204
ILE A 239
VAL A 236
THR A 257
 None
 1.24A 6debB-2p4zA:
undetectable		 6debB-2p4zA:
14.70
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.
2wqw INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 LEU A  61
LEU A  97
PRO A  98
PHE A  48
THR A  42
 None
 1.27A 6debB-2wqwA:
undetectable		 6debB-2wqwA:
15.69
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.
2y5q INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 LEU A  61
LEU A  97
PRO A  98
PHE A  48
THR A  42
 None
 1.21A 6debB-2y5qA:
undetectable		 6debB-2y5qA:
13.96
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.
3ayd GALECTIN-3

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		5 LEU A 242
LEU A 120
PRO A 121
ILE A 132
VAL A 202
 None
 1.18A 6debB-3aydA:
undetectable		 6debB-3aydA:
18.60
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.
3b05 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Sulfolobus
shibatae) 		PF01070
(FMN_dh) 		5 LEU A 176
LEU A 156
SER A 257
ILE A 199
VAL A 261
 None
 1.26A 6debB-3b05A:
undetectable		 6debB-3b05A:
12.58
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.
3e96 DIHYDRODIPICOLINATE
SYNTHASE

(Bacillus
clausii) 		PF00701
(DHDPS) 		5 LEU A 297
LEU A 218
PHE A 248
ILE A 264
VAL A 261
 None
 1.17A 6debB-3e96A:
undetectable		 6debB-3e96A:
15.20
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.
3e9a 2-DEHYDRO-3-DEOXYPHO
SPHOOCTONATE
ALDOLASE

(Vibrio cholerae) 		PF00793
(DAHP_synth_1) 		5 LEU A 114
PRO A 115
PHE A 155
THR A 131
ILE A 135
 None
SO4  A 284 (-4.2A)
None
None
None
 1.17A 6debB-3e9aA:
undetectable		 6debB-3e9aA:
16.06
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.
3gaz ALCOHOL
DEHYDROGENASE
SUPERFAMILY PROTEIN

(Novosphingobium
aromaticivorans) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 LEU A 285
LEU A 131
THR A 137
VAL A 163
THR A 268
 None
 1.19A 6debB-3gazA:
6.6		 6debB-3gazA:
12.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l07 BIFUNCTIONAL PROTEIN
FOLD

(Francisella
tularensis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		7 GLN A  96
LEU A  97
PRO A  98
ASP A 119
THR A 141
VAL A 170
THR A 265
 None
EDO  A 507 ( 4.7A)
None
EDO  A 507 (-3.9A)
None
None
None
 0.63A 6debB-3l07A:
42.2		 6debB-3l07A:
50.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l07 BIFUNCTIONAL PROTEIN
FOLD

(Francisella
tularensis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 GLN A  96
LEU A  97
PRO A  98
LYS A 105
ASP A 119
THR A 265
 None
EDO  A 507 ( 4.7A)
None
None
EDO  A 507 (-3.9A)
None
 0.50A 6debB-3l07A:
42.2		 6debB-3l07A:
50.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l07 BIFUNCTIONAL PROTEIN
FOLD

(Francisella
tularensis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLN A  96
PRO A  98
LYS A 105
PHE A 121
THR A 265
 None
None
None
EDO  A 507 (-4.9A)
None
 0.99A 6debB-3l07A:
42.2		 6debB-3l07A:
50.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l07 BIFUNCTIONAL PROTEIN
FOLD

(Francisella
tularensis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 GLN A  96
PRO A  98
PHE A 121
THR A 141
VAL A 170
THR A 265
 None
None
EDO  A 507 (-4.9A)
None
None
None
 0.82A 6debB-3l07A:
42.2		 6debB-3l07A:
50.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l07 BIFUNCTIONAL PROTEIN
FOLD

(Francisella
tularensis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		7 LEU A  94
GLN A  96
LEU A  97
PRO A  98
ASP A 119
THR A 141
THR A 265
 EDO  A 507 (-4.6A)
None
EDO  A 507 ( 4.7A)
None
EDO  A 507 (-3.9A)
None
None
 0.54A 6debB-3l07A:
42.2		 6debB-3l07A:
50.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l07 BIFUNCTIONAL PROTEIN
FOLD

(Francisella
tularensis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 LEU A  94
GLN A  96
LEU A  97
PRO A  98
ASP A 119
THR A 265
 EDO  A 507 (-4.6A)
None
EDO  A 507 ( 4.7A)
None
EDO  A 507 (-3.9A)
None
 0.85A 6debB-3l07A:
42.2		 6debB-3l07A:
50.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l07 BIFUNCTIONAL PROTEIN
FOLD

(Francisella
tularensis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 LEU A  97
PRO A  98
LYS A 105
ASP A 119
THR A 141
 EDO  A 507 ( 4.7A)
None
None
EDO  A 507 (-3.9A)
None
 1.00A 6debB-3l07A:
42.2		 6debB-3l07A:
50.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l07 BIFUNCTIONAL PROTEIN
FOLD

(Francisella
tularensis) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 PRO A  98
PHE A 121
THR A 141
SER A 167
VAL A 170
THR A 265
 None
EDO  A 507 (-4.9A)
None
None
None
None
 0.86A 6debB-3l07A:
42.2		 6debB-3l07A:
50.62
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.
3ll8 SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2B
CATALYTIC SUBUNIT
ALPHA ISOFORM

(Homo sapiens) 		PF00149
(Metallophos) 		5 LEU A 136
LEU A  98
PHE A 115
THR A  86
VAL A 321
 None
 1.21A 6debB-3ll8A:
undetectable		 6debB-3ll8A:
14.74
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.
3ngx BIFUNCTIONAL PROTEIN
FOLD

(Thermoplasma
acidophilum) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 PRO A  93
ASP A 114
THR A 135
SER A 159
VAL A 162
 None
 0.63A 6debB-3ngxA:
37.5		 6debB-3ngxA:
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.
3nwn KINESIN-LIKE PROTEIN
KIF9

(Homo sapiens) 		PF00225
(Kinesin) 		5 LEU A 246
LEU A 313
PHE A 333
ILE A 279
THR A 298
 None
 1.10A 6debB-3nwnA:
undetectable		 6debB-3nwnA:
11.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3op0 SIGNAL TRANSDUCTION
PROTEIN CBL-C

(Homo sapiens) 		PF02262
(Cbl_N)
PF02761
(Cbl_N2)
PF02762
(Cbl_N3) 		5 LEU A 194
PRO A 184
PHE A 175
SER A 163
THR A 215
 None
 1.22A 6debB-3op0A:
undetectable		 6debB-3op0A:
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.
3tlm SARCOPLASMIC/ENDOPLA
SMIC RETICULUM
CALCIUM ATPASE 1

(Bos taurus) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF08282
(Hydrolase_3)
PF13246
(Cation_ATPase) 		5 GLN A 790
LEU A 791
PRO A 788
THR A 777
ILE A 774
 None
 1.20A 6debB-3tlmA:
undetectable		 6debB-3tlmA:
6.79
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.
3v0w WN1 222-5 FAB
(IGG2A) HEAVY CHAIN
WN1 222-5 FAB
(IGG2A) LIGHT CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 LEU H 124
PRO H 123
PHE L 135
THR H 165
VAL H 163
 None
 1.12A 6debB-3v0wH:
undetectable		 6debB-3v0wH:
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.
3zef PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		5 LEU B1850
LEU B1924
PRO B1925
PHE B1890
THR B1886
 None
 1.25A 6debB-3zefB:
undetectable		 6debB-3zefB:
4.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zzi ACETYLGLUTAMATE
KINASE

(Saccharomyces
cerevisiae) 		PF00696
(AA_kinase)
PF04768
(NAT) 		5 GLN A 299
LEU A 296
SER A 285
ILE A 284
THR A 280
 None
 1.24A 6debB-3zziA:
2.1		 6debB-3zziA:
10.91
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.
4a26 PUTATIVE
C-1-TETRAHYDROFOLATE
SYNTHASE,
CYTOPLASMIC

(Leishmania
major) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 ASP A 123
THR A 146
SER A 172
ILE A 174
VAL A 175
THR A 279
 None
 0.68A 6debB-4a26A:
39.2		 6debB-4a26A:
12.94
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.
4a26 PUTATIVE
C-1-TETRAHYDROFOLATE
SYNTHASE,
CYTOPLASMIC

(Leishmania
major) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLN A 100
ASP A 123
THR A 146
VAL A 175
THR A 279
 None
 0.66A 6debB-4a26A:
39.2		 6debB-4a26A:
12.94
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.
4a26 PUTATIVE
C-1-TETRAHYDROFOLATE
SYNTHASE,
CYTOPLASMIC

(Leishmania
major) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLN A 100
LEU A 101
PRO A 102
ASP A 123
THR A 279
 None
 0.62A 6debB-4a26A:
39.2		 6debB-4a26A:
12.94
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.
4a26 PUTATIVE
C-1-TETRAHYDROFOLATE
SYNTHASE,
CYTOPLASMIC

(Leishmania
major) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLN A 100
PRO A 102
ASP A 123
THR A 146
THR A 279
 None
 0.63A 6debB-4a26A:
39.2		 6debB-4a26A:
12.94
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.
4a5o BIFUNCTIONAL PROTEIN
FOLD

(Pseudomonas
aeruginosa) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		7 LEU A  96
GLN A  98
LEU A  99
PRO A 100
ASP A 121
THR A 142
VAL A 171
 None
 1.02A 6debB-4a5oA:
36.8		 6debB-4a5oA:
24.06
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.
4a5o BIFUNCTIONAL PROTEIN
FOLD

(Pseudomonas
aeruginosa) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		7 LEU A  96
GLN A  98
PRO A 100
ASP A 121
THR A 142
VAL A 171
THR A 267
 None
 0.79A 6debB-4a5oA:
36.8		 6debB-4a5oA:
24.06
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.
4a5o BIFUNCTIONAL PROTEIN
FOLD

(Pseudomonas
aeruginosa) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 PRO A 100
THR A 142
ILE A 170
VAL A 171
THR A 267
 None
 1.04A 6debB-4a5oA:
36.8		 6debB-4a5oA:
24.06
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.
4b4u BIFUNCTIONAL PROTEIN
FOLD

(Acinetobacter
baumannii) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		7 LEU A  95
GLN A  97
ASP A 120
THR A 141
SER A 167
ILE A 169
THR A 265
 None
None
None
None
NAP  A1001 (-4.5A)
None
None
 1.04A 6debB-4b4uA:
40.9		 6debB-4b4uA:
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.
4b4u BIFUNCTIONAL PROTEIN
FOLD

(Acinetobacter
baumannii) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		7 LEU A  95
GLN A  97
PRO A  99
ASP A 120
THR A 141
ILE A 169
THR A 265
 None
 1.04A 6debB-4b4uA:
40.9		 6debB-4b4uA:
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.
4cjx C-1-TETRAHYDROFOLATE
SYNTHASE,
CYTOPLASMIC,
PUTATIVE

(Trypanosoma
brucei) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 GLN A 100
LEU A 101
PRO A 102
LYS A 109
ASP A 123
THR A 146
 9L9  A1300 (-3.5A)
9L9  A1300 (-4.1A)
NAP  A1301 (-4.7A)
None
9L9  A1300 (-3.0A)
None
 1.01A 6debB-4cjxA:
39.4		 6debB-4cjxA:
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.
4cjx C-1-TETRAHYDROFOLATE
SYNTHASE,
CYTOPLASMIC,
PUTATIVE

(Trypanosoma
brucei) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		7 GLN A 100
LEU A 101
PRO A 102
LYS A 109
ASP A 123
THR A 146
THR A 279
 9L9  A1300 (-3.5A)
9L9  A1300 (-4.1A)
NAP  A1301 (-4.7A)
None
9L9  A1300 (-3.0A)
None
9L9  A1300 ( 4.8A)
 0.75A 6debB-4cjxA:
39.4		 6debB-4cjxA:
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.
4cjx C-1-TETRAHYDROFOLATE
SYNTHASE,
CYTOPLASMIC,
PUTATIVE

(Trypanosoma
brucei) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 LEU A 101
PRO A 102
ASP A 123
THR A 146
ILE A 174
THR A 279
 9L9  A1300 (-4.1A)
NAP  A1301 (-4.7A)
9L9  A1300 (-3.0A)
None
9L9  A1300 ( 4.3A)
9L9  A1300 ( 4.8A)
 0.90A 6debB-4cjxA:
39.4		 6debB-4cjxA:
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.
4kmr TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Sanguibacter
keddieii) 		PF13377
(Peripla_BP_3) 		5 LEU A 149
LEU A 129
THR A 125
ILE A  71
VAL A  70
 None
 1.16A 6debB-4kmrA:
5.5		 6debB-4kmrA:
11.85
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.
4nh0 CELL
DIVISIONFTSK/SPOIIIE

(Thermomonospora
curvata) 		PF01580
(FtsK_SpoIIIE) 		5 LEU A 965
LEU A 798
PHE A 937
SER A 847
THR A 991
 None
 1.24A 6debB-4nh0A:
undetectable		 6debB-4nh0A:
6.54
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.
4nqk PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX58

(Homo sapiens) 		PF16739
(CARD_2) 		5 LEU A  58
LEU A   9
PHE A  73
ILE A  89
THR A  19
 None
 1.06A 6debB-4nqkA:
undetectable		 6debB-4nqkA:
19.70
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.
4ora SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2B
CATALYTIC SUBUNIT
BETA ISOFORM

(Homo sapiens) 		PF00149
(Metallophos) 		5 LEU A 145
LEU A 107
PHE A 124
THR A  95
VAL A 330
 None
 1.23A 6debB-4oraA:
undetectable		 6debB-4oraA:
9.71
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.
4orb SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2B
CATALYTIC SUBUNIT
ALPHA ISOFORM

(Mus musculus) 		PF00149
(Metallophos) 		5 LEU A 136
LEU A  98
PHE A 115
THR A  86
VAL A 321
 None
 1.23A 6debB-4orbA:
undetectable		 6debB-4orbA:
11.49
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.
4pbq PUTATIVE TRAP
PERIPLASMIC SOLUTE
BINDING PROTEIN

(Haemophilus
influenzae) 		PF03480
(DctP) 		5 LEU A 218
PRO A 170
ILE A 203
VAL A 202
THR A 196
 None
2UF  A 401 (-4.3A)
None
None
None
 1.21A 6debB-4pbqA:
undetectable		 6debB-4pbqA:
12.81
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.
4pq8 DESIGNED PROTEIN
OR465

(synthetic
construct) 		PF00560
(LRR_1)
PF12354
(Internalin_N)
PF13855
(LRR_8) 		5 LEU A  33
LEU A  69
PRO A  70
PHE A  20
THR A  14
 None
 1.27A 6debB-4pq8A:
undetectable		 6debB-4pq8A:
14.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4psj OR464

(synthetic
construct) 		PF12354
(Internalin_N)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A  33
LEU A  69
PRO A  70
PHE A  20
THR A  14
 None
 1.25A 6debB-4psjA:
undetectable		 6debB-4psjA:
17.00
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.
4qdg PUTATIVE ADHESIN

(Bacteroides
thetaiotaomicron) 		PF08842
(Mfa2) 		5 GLN A 187
LEU A 313
PHE A 198
ILE A 275
VAL A 273
 None
 1.20A 6debB-4qdgA:
undetectable		 6debB-4qdgA:
15.68
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.
4r58 LEUCINE RICH REPEAT
PROTEIN

(synthetic
construct) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6) 		5 LEU A  26
LEU A  62
PRO A  63
PHE A  13
THR A   7
 None
 1.28A 6debB-4r58A:
undetectable		 6debB-4r58A:
15.45
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.
4r5c LEUCINE RICH REPEAT
PROTEIN

(synthetic
construct) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A  25
LEU A  61
PRO A  62
PHE A  12
THR A   6
 None
 1.24A 6debB-4r5cA:
undetectable		 6debB-4r5cA:
12.97
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.
4r5d LEUCINE RICH REPEAT
PROTEIN

(synthetic
construct) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A  25
LEU A  61
PRO A  62
PHE A  12
THR A   6
 None
 1.23A 6debB-4r5dA:
undetectable		 6debB-4r5dA:
11.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r6g LEUCINE RICH REPEATS
DLRR_K

(synthetic
construct) 		PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A  25
LEU A  61
PRO A  62
PHE A  12
THR A   6
 None
 1.20A 6debB-4r6gA:
undetectable		 6debB-4r6gA:
10.60
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.
4uip REPEBODY (RAC1)

(Eptatretus
burgeri;
Listeria
monocytogenes;
synthetic
construct) 		PF11921
(DUF3439)
PF12354
(Internalin_N)
PF13855
(LRR_8) 		5 LEU B  27
LEU B  63
PRO B  64
PHE B  14
THR B   8
 None
 1.24A 6debB-4uipB:
undetectable		 6debB-4uipB:
18.23
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.
4wib MAGNESIUM
TRANSPORTER MGTE

(Thermus
thermophilus) 		PF01769
(MgtE) 		5 LEU A 324
PRO A 321
THR A 330
ILE A 397
VAL A 398
 None
 1.28A 6debB-4wibA:
undetectable		 6debB-4wibA:
17.34
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.
4wpz CYTOCHROME P450

(Streptomyces
avermitilis) 		PF00067
(p450) 		5 LEU A 175
LEU A 237
ILE A 153
VAL A 152
THR A 244
 None
None
None
None
HEM  A 503 (-4.1A)
 1.20A 6debB-4wpzA:
undetectable		 6debB-4wpzA:
11.70
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.
4xgt FRQ-INTERACTING RNA
HELICASE

(Neurospora
crassa) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF08148
(DSHCT)
PF13234
(rRNA_proc-arch) 		6 LEU A 517
GLN A 494
LEU A 492
PRO A 493
ILE A1098
VAL A1099
 None
 1.46A 6debB-4xgtA:
2.5		 6debB-4xgtA:
6.31
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.
5a6g PORE DOMAIN OF
POTASSIUM CHANNEL
SUBFAMILY T MEMBER 1

(Gallus gallus) 		PF07885
(Ion_trans_2) 		6 LEU B 257
GLN B 324
LEU B 321
PRO B 322
PHE B 291
THR B 263
 None
 1.43A 6debB-5a6gB:
undetectable		 6debB-5a6gB:
24.74
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.
5a6g PORE DOMAIN OF
POTASSIUM CHANNEL
SUBFAMILY T MEMBER 1

(Gallus gallus) 		PF07885
(Ion_trans_2) 		5 LEU B 257
GLN B 324
LEU B 321
PRO B 322
THR B 263
 None
 1.26A 6debB-5a6gB:
undetectable		 6debB-5a6gB:
24.74
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.
5b8i SERINE/THREONINE-PRO
TEIN PHOSPHATASE

(Coccidioides
immitis) 		PF00149
(Metallophos) 		5 LEU A 154
LEU A 116
PHE A 133
THR A 104
VAL A 339
 None
None
None
EDO  A 406 (-4.0A)
None
 1.21A 6debB-5b8iA:
undetectable		 6debB-5b8iA:
12.47
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.
5ee4 HPUA

(Kingella
denitrificans) 		PF16960
(HpuA) 		5 LEU A  89
PHE A 138
SER A 192
ILE A 180
THR A 303
 None
 1.26A 6debB-5ee4A:
undetectable		 6debB-5ee4A:
18.06
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.
5esa ANTI-HCV E2
GLYCOPROTEIN FAB
HEAVY CHAIN
ANTI-HCV E2
GLYCOPROTEIN FAB
LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 LEU A 130
PRO A 129
PHE B 134
THR A 171
VAL A 169
 None
 1.16A 6debB-5esaA:
undetectable		 6debB-5esaA:
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.
5gyk MITOCHONDRIAL
DISTRIBUTION AND
MORPHOLOGY PROTEIN
12

(Saccharomyces
cerevisiae) 		PF10296
(MMM1) 		5 LEU A 177
PRO A 259
SER A 212
ILE A 213
VAL A 214
 None
 1.17A 6debB-5gykA:
undetectable		 6debB-5gykA:
17.52
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.
5h9p GALECTIN-3

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		5 LEU A 242
LEU A 120
PRO A 121
ILE A 132
VAL A 202
 None
 1.17A 6debB-5h9pA:
undetectable		 6debB-5h9pA:
17.88
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.
5i4e MYOSIN-14,ALPHA-ACTI
NIN A

(Dictyostelium
discoideum;
Homo sapiens) 		PF00063
(Myosin_head)
PF00435
(Spectrin)
PF02736
(Myosin_N) 		5 GLN A 150
LEU A 151
PRO A 152
ILE A 134
VAL A 144
 None
 1.16A 6debB-5i4eA:
undetectable		 6debB-5i4eA:
6.93
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.
5kxb WISTERIA FLORIBUNDA
AGGLUTININ

(Wisteria
floribunda) 		PF00139
(Lectin_legB) 		5 LEU A 137
ASP A 157
SER A 176
ILE A 177
VAL A 178
 None
CA  A 308 ( 2.2A)
None
None
None
 1.28A 6debB-5kxbA:
undetectable		 6debB-5kxbA:
14.35
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.
5kxb WISTERIA FLORIBUNDA
AGGLUTININ

(Wisteria
floribunda) 		PF00139
(Lectin_legB) 		5 PRO A 133
ASP A 157
SER A 176
ILE A 177
VAL A 178
 None
CA  A 308 ( 2.2A)
None
None
None
 1.15A 6debB-5kxbA:
undetectable		 6debB-5kxbA:
14.35
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.
5kzt PEPTIDE/NICKEL
TRANSPORT SYSTEM
SUBSTRATE-BINDING
PROTEIN

(Listeria
monocytogenes) 		PF00496
(SBP_bac_5) 		5 LEU A 466
LEU A 514
PHE A 469
ILE A 521
THR A 302
 None
 1.27A 6debB-5kztA:
undetectable		 6debB-5kztA:
10.70
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.
5mz6 SEPARASE

(Caenorhabditis
elegans) 		PF03568
(Peptidase_C50) 		5 LEU 1 953
PRO 1 952
LYS 1 949
ILE 1 955
VAL 1 957
 None
 1.22A 6debB-5mz61:
undetectable		 6debB-5mz61:
5.33
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.
5nfb GALECTIN-3

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		5 LEU A 242
LEU A 120
PRO A 121
ILE A 132
VAL A 202
 None
 1.21A 6debB-5nfbA:
undetectable		 6debB-5nfbA:
18.07
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.
5nfn JMJC
DOMAIN-CONTAINING
PROTEIN 7

(Homo sapiens) 		no annotation 5 LEU A 109
LEU A  69
PRO A  70
ILE A 286
VAL A 189
 None
 1.27A 6debB-5nfnA:
undetectable		 6debB-5nfnA:
20.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5nhs BIFUNCTIONAL PROTEIN
FOLD

(Xanthomonas
albilineans) 		no annotation 5 GLN A 107
LEU A 108
PRO A 109
ASP A 130
THR A 278
 None
 0.90A 6debB-5nhsA:
25.3		 6debB-5nhsA:
33.75
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.
5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE

(Methanocaldococcus
jannaschii) 		no annotation 5 LEU A 394
PHE A 374
SER A 454
ILE A  14
VAL A 450
 None
 1.10A 6debB-5od2A:
4.0		 6debB-5od2A:
18.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t9g GLYCOSIDE HYDROLASE

(Bacteroides
uniformis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 LEU A 744
PHE A 782
THR A 811
SER A 835
ILE A 780
 None
 1.02A 6debB-5t9gA:
undetectable		 6debB-5t9gA:
7.44
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.
5tc4 BIFUNCTIONAL
METHYLENETETRAHYDROF
OLATE
DEHYDROGENASE/CYCLOH
YDROLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLN A 132
LEU A 133
PRO A 134
ASP A 155
THR A 176
 L34  A 402 (-3.4A)
L34  A 402 (-4.1A)
None
L34  A 402 (-2.9A)
NAD  A 401 (-3.2A)
 0.80A 6debB-5tc4A:
41.6		 6debB-5tc4A:
15.94
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.
5tc4 BIFUNCTIONAL
METHYLENETETRAHYDROF
OLATE
DEHYDROGENASE/CYCLOH
YDROLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		10 LEU A 130
GLN A 132
LEU A 133
PRO A 134
ASP A 155
PHE A 157
THR A 176
SER A 202
VAL A 205
THR A 316
 L34  A 402 ( 4.7A)
L34  A 402 (-3.4A)
L34  A 402 (-4.1A)
None
L34  A 402 (-2.9A)
L34  A 402 (-4.9A)
NAD  A 401 (-3.2A)
NAD  A 401 (-2.4A)
NAD  A 401 (-4.1A)
NAD  A 401 (-3.2A)
 0.63A 6debB-5tc4A:
41.6		 6debB-5tc4A:
15.94
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.
5tc4 BIFUNCTIONAL
METHYLENETETRAHYDROF
OLATE
DEHYDROGENASE/CYCLOH
YDROLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 LEU A 130
LEU A 133
PRO A 134
ASP A 155
THR A 316
 L34  A 402 ( 4.7A)
L34  A 402 (-4.1A)
None
L34  A 402 (-2.9A)
NAD  A 401 (-3.2A)
 0.97A 6debB-5tc4A:
41.6		 6debB-5tc4A:
15.94
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.
5vjw RHIZOBIALES-LIKE
PHOSPHATASE 2

(Arabidopsis
thaliana) 		no annotation 5 LEU A  89
THR A  55
ILE A  59
VAL A  58
THR A 159
 None
 1.28A 6debB-5vjwA:
undetectable		 6debB-5vjwA:
17.65
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.
5yeu -

(-) 		no annotation 5 LEU A 454
LEU A 190
PHE A 458
ILE A 210
VAL A 209
 None
 1.28A 6debB-5yeuA:
undetectable		 6debB-5yeuA:
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.
6ape BIFUNCTIONAL PROTEIN
FOLD

(Helicobacter
pylori) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		10 LEU A  99
GLN A 101
LEU A 102
PRO A 103
ASP A 124
PHE A 126
THR A 145
SER A 171
ILE A 173
THR A 270
 None
None
None
None
GOL  A 305 (-2.9A)
None
None
None
None
GOL  A 305 (-4.7A)
 0.51A 6debB-6apeA:
44.0		 6debB-6apeA:
16.61
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.
6ape BIFUNCTIONAL PROTEIN
FOLD

(Helicobacter
pylori) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		6 LEU A  99
GLN A 101
LEU A 102
PRO A 103
ASP A 124
THR A 270
 None
None
None
None
GOL  A 305 (-2.9A)
GOL  A 305 (-4.7A)
 0.91A 6debB-6apeA:
44.0		 6debB-6apeA:
16.61
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.
6bb4 MOUSE MONOCLONAL
ANTIBODY C5.2 FAB
HEAVY CHAIN
MOUSE MONOCLONAL
ANTIBODY C5.2 FAB
LIGHT CHAIN

(Mus musculus) 		no annotation 5 LEU H 124
PRO H 123
PHE L 135
THR H 165
VAL H 163
 None
 1.14A 6debB-6bb4H:
undetectable		 6debB-6bb4H:
25.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6de8 BIFUNCTIONAL PROTEIN
FOLD

(Campylobacter
jejuni) 		no annotation 12 LEU A  93
GLN A  95
LEU A  96
PRO A  97
LYS A 104
ASP A 118
PHE A 120
THR A 140
SER A 166
ILE A 168
VAL A 169
THR A 265
 None
None
IOD  A 304 ( 4.7A)
IOD  A 304 ( 4.8A)
IOD  A 303 (-4.1A)
None
None
None
IOD  A 303 ( 4.8A)
None
None
None
 0.37A 6debB-6de8A:
48.0		 6debB-6de8A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6de8 BIFUNCTIONAL PROTEIN
FOLD

(Campylobacter
jejuni) 		no annotation 7 LEU A  93
GLN A  95
LEU A  96
PRO A  97
LYS A 104
ASP A 118
THR A 265
 None
None
IOD  A 304 ( 4.7A)
IOD  A 304 ( 4.8A)
IOD  A 303 (-4.1A)
None
None
 1.03A 6debB-6de8A:
48.0		 6debB-6de8A:
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.
6fof GALECTIN-3,GALECTIN-
3

(Homo sapiens) 		no annotation 5 LEU C 242
LEU C 120
PRO C 121
ILE C 132
VAL C 202
 None
 1.12A 6debB-6fofC:
undetectable		 6debB-6fofC:
undetectable