SIMILAR PATTERNS OF AMINO ACIDS FOR 1JZS_A_MRCA1301_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.
1ad3 ALDEHYDE
DEHYDROGENASE (CLASS
3)

(Rattus
norvegicus) 		PF00171
(Aldedh) 		5 GLY A 282
GLY A 336
GLN A 241
LEU A 296
ILE A 297
 None
 0.88A 1jzsA-1ad3A:
undetectable		 1jzsA-1ad3A:
20.24
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.
1bf2 ISOAMYLASE

(Pseudomonas
amyloderamosa) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 GLY A 574
SER A 498
ASP A 431
GLN A 176
ILE A 287
 None
 1.24A 1jzsA-1bf2A:
undetectable		 1jzsA-1bf2A:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e19 CARBAMATE KINASE

(Pyrococcus
furiosus) 		PF00696
(AA_kinase) 		5 GLY A  54
HIS A  51
SER A  59
GLY A  11
LEU A 297
 None
None
None
ADP  A 315 (-3.5A)
None
 1.17A 1jzsA-1e19A:
1.7		 1jzsA-1e19A:
16.69
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.
1gkr NON-ATP DEPENDENT
L-SELECTIVE
HYDANTOINASE

(Paenarthrobacter
aurescens) 		PF01979
(Amidohydro_1) 		5 GLY A 264
HIS A  62
HIS A  60
GLY A 337
ILE A  63
 None
ZN  A1453 ( 3.3A)
ZN  A1453 ( 3.3A)
None
None
 1.00A 1jzsA-1gkrA:
undetectable		 1jzsA-1gkrA:
21.00
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.
1h3e TYROSYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		6 GLY A  43
HIS A  52
HIS A  55
GLY A 194
ASP A 196
GLN A 197
 TYE  A1434 ( 3.5A)
ATP  A1433 (-4.3A)
ATP  A1433 (-4.2A)
ATP  A1433 (-3.2A)
ATP  A1433 ( 4.2A)
TYE  A1434 ( 3.5A)
 0.71A 1jzsA-1h3eA:
1.1		 1jzsA-1h3eA:
21.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ile ISOLEUCYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		11 GLY A  45
PRO A  46
HIS A  54
HIS A  57
SER A 521
GLU A 550
GLY A 551
ASP A 553
GLN A 554
LEU A 583
ILE A 584
 None
 0.51A 1jzsA-1ileA:
50.0		 1jzsA-1ileA:
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.
1j1u TYROSYL-TRNA
SYNTHETASE

(Methanocaldococcus
jannaschii) 		PF00579
(tRNA-synt_1b) 		5 GLY A  34
HIS A  42
HIS A  45
GLY A 170
GLN A 173
 TYR  A 401 (-3.4A)
None
None
None
TYR  A 401 (-3.0A)
 0.61A 1jzsA-1j1uA:
0.3		 1jzsA-1j1uA:
17.94
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.
1jik TYROSYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF00579
(tRNA-synt_1b) 		6 GLY A  38
HIS A  50
GLY A 193
ASP A 195
GLN A 196
LEU A 223
 545  A 421 (-4.2A)
545  A 421 (-3.7A)
545  A 421 (-3.6A)
545  A 421 (-2.9A)
545  A 421 (-3.4A)
None
 0.96A 1jzsA-1jikA:
2.0		 1jzsA-1jikA:
19.57
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.
1k4m NAMN
ADENYLYLTRANSFERASE

(Escherichia
coli) 		PF01467
(CTP_transf_like) 		5 GLY A   9
HIS A  16
HIS A  19
GLY A 107
ASP A 109
 NAD  A 601 (-3.1A)
None
NAD  A 601 (-4.5A)
NAD  A 601 (-3.1A)
NAD  A 601 ( 2.9A)
 0.78A 1jzsA-1k4mA:
0.0		 1jzsA-1k4mA:
13.88
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.
1kke SIGMA 1 PROTEIN

(Mammalian
orthoreovirus) 		PF01664
(Reo_sigma1) 		5 GLY A 330
HIS A 438
GLY A 363
ASP A 362
ILE A 401
 None
 1.12A 1jzsA-1kkeA:
undetectable		 1jzsA-1kkeA:
13.48
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.
1kyh HYPOTHETICAL 29.9
KDA PROTEIN IN
SIGY-CYDD INTERGENIC
REGION

(Bacillus
subtilis) 		PF01256
(Carb_kinase) 		5 GLY A  41
PRO A  40
GLY A  47
LEU A 223
ILE A 222
 None
 1.07A 1jzsA-1kyhA:
undetectable		 1jzsA-1kyhA:
16.67
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.
1mmf GLYCEROL DEHYDRASE
BETA SUBUNIT

(Klebsiella
pneumoniae) 		PF02288
(Dehydratase_MU) 		5 GLY B  35
PRO B  36
GLY B 103
GLN B 100
ILE B  47
 None
 1.21A 1jzsA-1mmfB:
undetectable		 1jzsA-1mmfB:
13.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mmf GLYCEROL DEHYDRASE
BETA SUBUNIT

(Klebsiella
pneumoniae) 		PF02288
(Dehydratase_MU) 		5 GLY B  35
PRO B  36
HIS B  51
GLN B 100
LEU B 127
 None
 1.10A 1jzsA-1mmfB:
undetectable		 1jzsA-1mmfB:
13.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o99 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Geobacillus
stearothermophilus) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 HIS A 462
HIS A 407
GLU A 231
GLY A 152
ASP A 151
 MN  A 601 ( 3.3A)
MN  A 601 ( 3.2A)
None
None
None
 1.25A 1jzsA-1o99A:
undetectable		 1jzsA-1o99A:
20.48
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.
1poc PHOSPHOLIPASE A2

(Apis mellifera) 		PF05826
(Phospholip_A2_2) 		5 GLY A  17
PRO A  18
GLU A  20
GLY A  22
ASP A  28
 None
 1.23A 1jzsA-1pocA:
undetectable		 1jzsA-1pocA:
10.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qu2 ISOLEUCYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF00133
(tRNA-synt_1)
PF06827
(zf-FPG_IleRS)
PF08264
(Anticodon_1) 		9 GLY A  55
PRO A  56
HIS A  64
HIS A  67
SER A 531
GLU A 554
GLY A 555
ASP A 557
GLN A 558
 MRC  A1993 ( 4.1A)
MRC  A1993 (-3.4A)
MRC  A1993 (-4.1A)
MRC  A1993 (-4.1A)
MRC  A1993 ( 4.0A)
MRC  A1993 (-3.2A)
MRC  A1993 (-3.8A)
MRC  A1993 (-3.2A)
MRC  A1993 (-3.5A)
 0.60A 1jzsA-1qu2A:
32.5		 1jzsA-1qu2A:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qu2 ISOLEUCYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF00133
(tRNA-synt_1)
PF06827
(zf-FPG_IleRS)
PF08264
(Anticodon_1) 		5 SER A 565
GLU A 554
GLY A 555
ASP A 557
GLN A 558
 None
MRC  A1993 (-3.2A)
MRC  A1993 (-3.8A)
MRC  A1993 (-3.2A)
MRC  A1993 (-3.5A)
 1.14A 1jzsA-1qu2A:
32.5		 1jzsA-1qu2A:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qu2 ISOLEUCYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF00133
(tRNA-synt_1)
PF06827
(zf-FPG_IleRS)
PF08264
(Anticodon_1) 		5 SER A 566
GLU A 554
GLY A 555
ASP A 557
GLN A 558
 None
MRC  A1993 (-3.2A)
MRC  A1993 (-3.8A)
MRC  A1993 (-3.2A)
MRC  A1993 (-3.5A)
 1.21A 1jzsA-1qu2A:
32.5		 1jzsA-1qu2A:
30.94
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.
1r6u TRYPTOPHANYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		5 GLY A 161
HIS A 170
HIS A 173
ASP A 312
GLN A 313
 TYM  A 501 (-3.6A)
None
TYM  A 501 (-4.6A)
TYM  A 501 (-3.2A)
TYM  A 501 (-3.6A)
 0.94A 1jzsA-1r6uA:
undetectable		 1jzsA-1r6uA:
19.30
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.
1rpt PROSTATIC ACID
PHOSPHATASE

(Rattus
norvegicus) 		PF00328
(His_Phos_2) 		5 GLY A  16
PRO A  17
HIS A 257
GLN A  37
LEU A  81
 None
None
VO4  A 343 (-3.8A)
None
None
 1.21A 1jzsA-1rptA:
undetectable		 1jzsA-1rptA:
18.28
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.
1tyd TYROSYL-TRNA
SYNTHETASE

(Geobacillus
stearothermophilus) 		PF00579
(tRNA-synt_1b) 		5 GLY E  36
HIS E  45
HIS E  48
GLY E 192
ASP E 194
 TYR  E 320 (-3.3A)
None
None
None
None
 0.83A 1jzsA-1tydE:
undetectable		 1jzsA-1tydE:
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.
1tyd TYROSYL-TRNA
SYNTHETASE

(Geobacillus
stearothermophilus) 		PF00579
(tRNA-synt_1b) 		6 GLY E  36
HIS E  48
GLY E 192
ASP E 194
GLN E 195
LEU E 222
 TYR  E 320 (-3.3A)
None
None
None
TYR  E 320 (-3.3A)
None
 0.73A 1jzsA-1tydE:
undetectable		 1jzsA-1tydE:
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.
1uc4 DIOL DEHYDRASE BETA
SUBUNIT

(Klebsiella
oxytoca) 		PF02288
(Dehydratase_MU) 		5 GLY B  68
PRO B  69
HIS B  84
GLN B 133
LEU B 160
 None
None
None
CNC  B2601 ( 4.7A)
None
 1.06A 1jzsA-1uc4B:
undetectable		 1jzsA-1uc4B:
14.98
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.
1un9 DIHYDROXYACETONE
KINASE

(Citrobacter
freundii) 		PF02733
(Dak1)
PF02734
(Dak2) 		5 GLY A 151
HIS A  65
SER A 188
LEU A 105
ILE A  54
 None
 1.14A 1jzsA-1un9A:
undetectable		 1jzsA-1un9A:
21.89
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.
1vbm TYROSYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF00579
(tRNA-synt_1b) 		6 GLY A  39
HIS A  48
HIS A  51
GLY A 198
ASP A 200
GLN A 201
 YSA  A3001 (-3.1A)
SO4  A2003 (-3.9A)
YSA  A3001 ( 3.8A)
YSA  A3001 (-3.0A)
YSA  A3001 (-3.2A)
YSA  A3001 (-3.5A)
 0.71A 1jzsA-1vbmA:
undetectable		 1jzsA-1vbmA:
18.65
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.
1vbm TYROSYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF00579
(tRNA-synt_1b) 		6 GLY A  39
HIS A  51
GLY A 198
ASP A 200
GLN A 201
ILE A 228
 YSA  A3001 (-3.1A)
YSA  A3001 ( 3.8A)
YSA  A3001 (-3.0A)
YSA  A3001 (-3.2A)
YSA  A3001 (-3.5A)
YSA  A3001 (-4.1A)
 0.78A 1jzsA-1vbmA:
undetectable		 1jzsA-1vbmA:
18.65
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.
1vg0 RAB PROTEINS
GERANYLGERANYLTRANSF
ERASE COMPONENT A 1

(Rattus
norvegicus) 		PF00996
(GDI) 		5 GLY A 574
PRO A 575
GLU A 432
GLY A  15
ASP A  38
 None
 1.26A 1jzsA-1vg0A:
undetectable		 1jzsA-1vg0A:
21.10
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.
2cyb TYROSYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF00579
(tRNA-synt_1b) 		6 GLY A  38
HIS A  46
HIS A  49
GLY A 177
ASP A 179
GLN A 180
 None
 0.66A 1jzsA-2cybA:
undetectable		 1jzsA-2cybA:
18.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cyc TYROSYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00579
(tRNA-synt_1b) 		5 GLY A  39
HIS A  47
GLY A 187
ASP A 189
GLN A 190
 TYR  A 701 (-3.4A)
None
None
None
TYR  A 701 (-3.3A)
 0.62A 1jzsA-2cycA:
3.0		 1jzsA-2cycA:
19.25
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.
2dlc TYROSYL-TRNA
SYNTHETASE,
CYTOPLASMIC

(Saccharomyces
cerevisiae) 		PF00579
(tRNA-synt_1b) 		5 GLY X  45
HIS X  53
GLY X 189
ASP X 191
GLN X 192
 YMP  X 601 (-3.5A)
YMP  X 601 (-4.3A)
YMP  X 601 (-2.8A)
YMP  X 601 (-3.2A)
YMP  X 601 (-3.4A)
 0.70A 1jzsA-2dlcX:
undetectable		 1jzsA-2dlcX:
20.46
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.
2dws COPPER-CONTAINING
NITRITE REDUCTASE

(Rhodobacter
sphaeroides) 		PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3) 		5 GLY A 171
PRO A 172
HIS A 126
HIS A 177
ILE A 145
 None
None
CU  A 401 (-3.2A)
CU  A 401 (-3.1A)
None
 1.15A 1jzsA-2dwsA:
undetectable		 1jzsA-2dwsA:
19.24
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.
2eid GALACTOSE OXIDASE

(Fusarium
graminearum) 		PF00754
(F5_F8_type_C)
PF01344
(Kelch_1)
PF09118
(DUF1929) 		5 GLY A 230
PRO A 229
HIS A 334
GLY A 287
LEU A 321
 None
 1.17A 1jzsA-2eidA:
undetectable		 1jzsA-2eidA:
20.14
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.
2g04 PROBABLE
FATTY-ACID-COA
RACEMASE FAR

(Mycobacterium
tuberculosis) 		PF02515
(CoA_transf_3) 		5 GLY A 120
PRO A 121
ASP A 192
LEU A 165
ILE A 113
 None
 1.10A 1jzsA-2g04A:
undetectable		 1jzsA-2g04A:
19.28
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.
2h29 PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Staphylococcus
aureus) 		PF01467
(CTP_transf_like) 		5 GLY A   8
HIS A  15
HIS A  18
GLY A 106
ASP A 108
 DND  A 998 (-3.2A)
None
DND  A 998 ( 4.6A)
DND  A 998 (-3.1A)
DND  A 998 (-3.0A)
 0.84A 1jzsA-2h29A:
undetectable		 1jzsA-2h29A:
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.
2h29 PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Staphylococcus
aureus) 		PF01467
(CTP_transf_like) 		5 GLY A   8
HIS A  18
GLY A 106
ASP A 108
GLN A 109
 DND  A 998 (-3.2A)
DND  A 998 ( 4.6A)
DND  A 998 (-3.1A)
DND  A 998 (-3.0A)
DND  A 998 (-3.4A)
 0.90A 1jzsA-2h29A:
undetectable		 1jzsA-2h29A:
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.
2iuk SEED LIPOXYGENASE

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 GLY A 852
GLU A 851
ASP A 786
LEU A 272
ILE A  28
 None
 1.24A 1jzsA-2iukA:
undetectable		 1jzsA-2iukA:
22.70
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.
2jan TYROSYL-TRNA
SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00579
(tRNA-synt_1b) 		6 GLY A  38
HIS A  47
HIS A  50
GLY A 194
ASP A 196
GLN A 197
 None
 0.89A 1jzsA-2janA:
undetectable		 1jzsA-2janA:
20.29
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.
2o01 PSI LIGHT-HARVESTING
ANTENNA CHLOROPHYLL
A/B-BINDING PROTEIN

(Pisum sativum) 		PF00504
(Chloroa_b-bind) 		5 GLY 4 177
PRO 4 178
GLY 4 166
GLN 4 170
LEU 4 162
 None
None
CLA  44003 ( 3.8A)
CLA  44003 (-3.1A)
CLA  44003 (-4.7A)
 1.24A 1jzsA-2o014:
undetectable		 1jzsA-2o014:
11.57
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.
2pid TYROSYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		6 GLY A  79
HIS A  88
HIS A  91
GLY A 244
ASP A 246
GLN A 247
 YSA  A 384 (-3.2A)
None
YSA  A 384 (-4.1A)
YSA  A 384 (-2.5A)
YSA  A 384 (-3.3A)
YSA  A 384 (-3.2A)
 0.65A 1jzsA-2pidA:
undetectable		 1jzsA-2pidA:
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.
2pid TYROSYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		6 GLY A  79
HIS A  91
GLY A 244
ASP A 246
GLN A 247
ILE A 274
 YSA  A 384 (-3.2A)
YSA  A 384 (-4.1A)
YSA  A 384 (-2.5A)
YSA  A 384 (-3.3A)
YSA  A 384 (-3.2A)
YSA  A 384 (-4.4A)
 0.57A 1jzsA-2pidA:
undetectable		 1jzsA-2pidA:
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.
2plc PHOSPHATIDYLINOSITOL
-SPECIFIC
PHOSPHOLIPASE C

(Listeria
monocytogenes) 		PF00388
(PI-PLC-X) 		5 PRO A  61
HIS A  93
GLY A  52
ASP A  53
ILE A  91
 None
 1.08A 1jzsA-2plcA:
undetectable		 1jzsA-2plcA:
15.36
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.
2qcm URIDINE
5'-MONOPHOSPHATE
SYNTHASE (UMP
SYNTHASE)

(Homo sapiens) 		PF00215
(OMPdecase) 		5 GLY A 418
SER A 373
GLY A 450
ASP A 259
ILE A 277
 JW5  A 482 ( 4.9A)
None
JW5  A 482 (-3.4A)
JW5  A 482 (-2.9A)
None
 1.24A 1jzsA-2qcmA:
undetectable		 1jzsA-2qcmA:
16.20
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.
2rkj TYROSYL-TRNA
SYNTHETASE

(Neurospora
crassa) 		PF00579
(tRNA-synt_1b) 		6 GLY A 101
HIS A 110
HIS A 113
GLY A 270
ASP A 272
GLN A 273
 None
 0.89A 1jzsA-2rkjA:
undetectable		 1jzsA-2rkjA:
18.74
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.
2rkj TYROSYL-TRNA
SYNTHETASE

(Neurospora
crassa) 		PF00579
(tRNA-synt_1b) 		6 GLY A 101
HIS A 113
GLY A 270
ASP A 272
GLN A 273
LEU A 316
 None
 0.84A 1jzsA-2rkjA:
undetectable		 1jzsA-2rkjA:
18.74
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.
2ts1 TYROSYL-TRNA
SYNTHETASE

(Geobacillus
stearothermophilus) 		PF00579
(tRNA-synt_1b) 		5 GLY A  36
HIS A  45
HIS A  48
GLY A 192
ASP A 194
 None
 0.87A 1jzsA-2ts1A:
undetectable		 1jzsA-2ts1A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ts1 TYROSYL-TRNA
SYNTHETASE

(Geobacillus
stearothermophilus) 		PF00579
(tRNA-synt_1b) 		6 GLY A  36
HIS A  48
GLY A 192
ASP A 194
GLN A 195
LEU A 222
 None
 0.74A 1jzsA-2ts1A:
undetectable		 1jzsA-2ts1A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xrm INTRACELLULAR
SUBTILISIN PROTEASE

(Bacillus
clausii) 		PF00082
(Peptidase_S8) 		5 GLY A 102
SER A  19
GLY A  92
LEU A 112
ILE A  63
 NA  A 401 ( 4.7A)
None
None
None
None
 1.07A 1jzsA-2xrmA:
undetectable		 1jzsA-2xrmA:
17.05
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.
2yjn GLYCOSYLTRANSFERASE

(Saccharopolyspora
erythraea) 		PF06722
(DUF1205) 		5 GLY A 253
PRO A 254
HIS A 330
GLY A 346
ILE A 353
 None
 1.05A 1jzsA-2yjnA:
undetectable		 1jzsA-2yjnA:
20.96
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.
2yy5 TRYPTOPHANYL-TRNA
SYNTHETASE

(Mycoplasma
pneumoniae) 		PF00579
(tRNA-synt_1b) 		5 GLY A   8
HIS A  16
GLY A 152
ASP A 154
GLN A 155
 WSA  A1350 (-3.7A)
SO4  A1362 ( 4.1A)
WSA  A1350 (-3.2A)
WSA  A1350 (-2.7A)
SO4  A1363 ( 3.2A)
 0.81A 1jzsA-2yy5A:
undetectable		 1jzsA-2yy5A:
17.43
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.
2yy5 TRYPTOPHANYL-TRNA
SYNTHETASE

(Mycoplasma
pneumoniae) 		PF00579
(tRNA-synt_1b) 		5 GLY A   8
HIS A  16
GLY A 152
GLN A 155
ILE A 191
 WSA  A1350 (-3.7A)
SO4  A1362 ( 4.1A)
WSA  A1350 (-3.2A)
SO4  A1363 ( 3.2A)
WSA  A1350 (-3.7A)
 0.89A 1jzsA-2yy5A:
undetectable		 1jzsA-2yy5A:
17.43
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.
3c8z CYSTEINYL-TRNA
SYNTHETASE

(Mycolicibacterium
smegmatis) 		PF01406
(tRNA-synt_1e) 		6 GLY A  44
HIS A  52
HIS A  55
GLY A 249
ASP A 251
ILE A 283
 None
5CA  A 418 ( 4.9A)
5CA  A 418 (-4.3A)
5CA  A 418 (-3.0A)
5CA  A 418 (-3.1A)
5CA  A 418 (-4.4A)
 0.86A 1jzsA-3c8zA:
16.9		 1jzsA-3c8zA:
20.57
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.
3cdi POLYNUCLEOTIDE
PHOSPHORYLASE

(Escherichia
coli) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		5 GLY A 425
SER A 462
ASP A 531
GLN A 529
ILE A 122
 None
 1.24A 1jzsA-3cdiA:
3.5		 1jzsA-3cdiA:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fot 15-O-ACETYLTRANSFERA
SE

(Fusarium
sporotrichioides) 		PF07428
(Tri3) 		5 PRO A 231
SER A 236
GLY A 193
ASP A 190
LEU A  53
 None
 1.24A 1jzsA-3fotA:
undetectable		 1jzsA-3fotA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jb9 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
PPI1
PRE-MRNA-PROCESSING
FACTOR 17

(Schizosaccharomyces
pombe) 		PF01423
(LSM) 		5 GLY g  68
PRO g  69
GLY d  63
ASP d  56
GLN d 101
 None
 1.21A 1jzsA-3jb9g:
undetectable		 1jzsA-3jb9g:
20.31
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.
3jxe TRYPTOPHANYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00579
(tRNA-synt_1b) 		5 GLY A  79
HIS A  87
HIS A  90
ASP A 216
GLN A 217
 TYM  A 400 (-3.4A)
SO4  A 393 (-3.9A)
SO4  A 393 ( 3.9A)
TYM  A 400 (-3.4A)
TYM  A 400 (-3.5A)
 1.03A 1jzsA-3jxeA:
2.9		 1jzsA-3jxeA:
17.70
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.
3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)

(Clostridium
acetobutylicum) 		PF07992
(Pyr_redox_2) 		5 GLY A 269
PRO A 268
GLY A 107
LEU A   9
ILE A   8
 FAD  A 401 (-4.3A)
None
FAD  A 401 (-3.1A)
FAD  A 401 (-4.7A)
None
 1.22A 1jzsA-3kljA:
undetectable		 1jzsA-3kljA:
19.77
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.
3ksd GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1

(Staphylococcus
aureus) 		no annotation 5 PRO Q 236
GLY Q 182
ASP Q 183
GLN Q 184
ILE Q  13
 None
None
None
None
NAD  Q 337 (-4.4A)
 1.14A 1jzsA-3ksdQ:
undetectable		 1jzsA-3ksdQ:
19.05
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.
3lto MEVALONATE
DIPHOSPHATE
DECARBOXYLASE

(Legionella
pneumophila) 		no annotation 5 GLY A 293
PRO A 294
HIS A 186
HIS A 297
SER A 193
 None
 1.20A 1jzsA-3ltoA:
undetectable		 1jzsA-3ltoA:
16.57
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.
3mue PANTOTHENATE
SYNTHETASE

(Salmonella
enterica) 		PF02569
(Pantoate_ligase) 		5 HIS A  34
HIS A  37
GLY A 149
ASP A 152
ILE A 178
 EOH  A 292 (-4.3A)
None
None
None
EOH  A 292 ( 4.0A)
 1.11A 1jzsA-3mueA:
undetectable		 1jzsA-3mueA:
16.77
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.
3s6x OUTER CAPSID PROTEIN
SIGMA-1

(Mammalian
orthoreovirus) 		PF01664
(Reo_sigma1) 		5 GLY A 330
HIS A 438
GLY A 363
ASP A 362
ILE A 401
 None
 1.22A 1jzsA-3s6xA:
undetectable		 1jzsA-3s6xA:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3swx PROBABLE ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacteroides
abscessus) 		PF00378
(ECH_1) 		5 GLY A  59
PRO A  60
HIS A 189
GLY A  19
ILE A 194
 None
 1.18A 1jzsA-3swxA:
undetectable		 1jzsA-3swxA:
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.
3tqo CYSTEINYL-TRNA
SYNTHETASE

(Coxiella
burnetii) 		PF01406
(tRNA-synt_1e)
PF09190
(DALR_2) 		5 GLY A  30
HIS A  38
HIS A  41
GLY A 228
LEU A 260
 None
 0.94A 1jzsA-3tqoA:
5.9		 1jzsA-3tqoA:
21.13
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.
3u0f BETA-KETOACYL
SYNTHASE

(Brucella
abortus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 106
PRO A 107
GLU A 189
GLY A 231
ILE A  11
 07L  A 411 (-3.5A)
None
07L  A 411 ( 4.0A)
None
None
 1.03A 1jzsA-3u0fA:
undetectable		 1jzsA-3u0fA:
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.
3uy4 PANTOTHENATE
SYNTHETASE

(Campylobacter
jejuni) 		PF02569
(Pantoate_ligase) 		5 HIS A  34
HIS A  37
GLY A 146
ASP A 149
ILE A 175
 AMP  A 301 ( 4.5A)
AMP  A 301 (-3.9A)
AMP  A 301 (-3.3A)
PAU  A 302 ( 3.7A)
AMP  A 301 (-4.2A)
 1.12A 1jzsA-3uy4A:
undetectable		 1jzsA-3uy4A:
15.99
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.
3vgj TYROSYL-TRNA
SYNTHETASE, PUTATIVE

(Plasmodium
falciparum) 		PF00579
(tRNA-synt_1b) 		5 GLY A  62
HIS A  70
GLY A 207
ASP A 209
GLN A 210
 TYR  A 401 ( 3.3A)
AMP  A 402 (-4.4A)
AMP  A 402 (-3.1A)
AMP  A 402 (-2.8A)
TYR  A 401 ( 3.3A)
 0.62A 1jzsA-3vgjA:
undetectable		 1jzsA-3vgjA:
17.45
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.
3vsc PROTEIN CYSO

(Aeropyrum
pernix) 		PF00291
(PALP) 		5 GLY A 261
HIS A 234
SER A 153
GLY A 258
ILE A 242
 SEP  A 402 ( 2.9A)
None
SEP  A 402 (-2.9A)
None
None
 1.24A 1jzsA-3vscA:
undetectable		 1jzsA-3vscA:
19.71
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.
3w1h L-SERYL-TRNA(SEC)
SELENIUM TRANSFERASE

(Aquifex
aeolicus) 		PF03841
(SelA) 		5 GLY A 249
SER A 217
GLY A 283
ASP A 284
ILE A 316
 LLP  A 285 ( 3.0A)
LLP  A 285 ( 3.1A)
LLP  A 285 ( 4.4A)
LLP  A 285 ( 4.3A)
None
 1.09A 1jzsA-3w1hA:
undetectable		 1jzsA-3w1hA:
21.17
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.
3zdf GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Thermosynechococcus
elongatus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 PRO A 237
GLY A 185
ASP A 186
GLN A 187
ILE A  12
 None
NAD  A1001 ( 4.9A)
None
None
NAD  A1001 (-4.1A)
 1.12A 1jzsA-3zdfA:
undetectable		 1jzsA-3zdfA:
17.25
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.
4do7 AMIDOHYDROLASE 2

(Burkholderia
multivorans) 		PF04909
(Amidohydro_2) 		5 HIS A   9
HIS A  11
GLU A  62
GLY A  81
ILE A  52
 ZN  A 401 (-4.2A)
ZN  A 401 (-3.3A)
None
None
None
 1.05A 1jzsA-4do7A:
undetectable		 1jzsA-4do7A:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f85 GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E

(Streptomyces
lasaliensis) 		PF02353
(CMAS) 		5 GLY A 115
HIS A  86
HIS A  56
SER A 159
ILE A  82
 None
 0.96A 1jzsA-4f85A:
undetectable		 1jzsA-4f85A:
17.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g9i HYDROGENASE
MATURATION PROTEIN
HYPF

(Thermococcus
kodakarensis) 		PF00708
(Acylphosphatase)
PF00814
(Peptidase_M22)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		5 HIS A 490
HIS A 486
SER A 550
GLY A 522
ILE A 491
 ZN  A1003 (-3.0A)
ZN  A1003 (-3.4A)
None
None
None
 1.11A 1jzsA-4g9iA:
undetectable		 1jzsA-4g9iA:
21.79
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.
4grh AMINODEOXYCHORISMATE
SYNTHASE

(Stenotrophomonas
maltophilia) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		5 GLY A  72
PRO A  71
GLY A  60
ASP A  59
GLN A  61
 None
None
15P  A 502 (-3.3A)
None
None
 1.12A 1jzsA-4grhA:
undetectable		 1jzsA-4grhA:
20.63
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.
4gw9 BACTERIOPHYTOCHROME

(Rhodopseudomonas
palustris) 		PF00360
(PHY)
PF00989
(PAS)
PF01590
(GAF)
PF08446
(PAS_2) 		5 GLY A 585
HIS A 560
GLY A 620
LEU A 541
ILE A 540
 None
 0.96A 1jzsA-4gw9A:
undetectable		 1jzsA-4gw9A:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j75 TRYPTOPHANYL-TRNA
SYNTHETASE

(Plasmodium
falciparum) 		PF00579
(tRNA-synt_1b) 		6 GLY A 308
HIS A 317
HIS A 320
GLY A 453
ASP A 455
GLN A 456
 TYM  A 701 (-3.4A)
None
TYM  A 701 ( 4.8A)
TYM  A 701 (-2.9A)
TYM  A 701 (-3.2A)
TYM  A 701 (-3.4A)
 0.99A 1jzsA-4j75A:
undetectable		 1jzsA-4j75A:
17.96
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.
4j75 TRYPTOPHANYL-TRNA
SYNTHETASE

(Plasmodium
falciparum) 		PF00579
(tRNA-synt_1b) 		6 GLY A 308
HIS A 317
SER A 343
GLY A 453
ASP A 455
GLN A 456
 TYM  A 701 (-3.4A)
None
TYM  A 701 (-3.6A)
TYM  A 701 (-2.9A)
TYM  A 701 (-3.2A)
TYM  A 701 (-3.4A)
 1.15A 1jzsA-4j75A:
undetectable		 1jzsA-4j75A:
17.96
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.
4onq DNA
METHYLTRANSFERASE

(Nicotiana
tabacum) 		PF00145
(DNA_methylase) 		5 GLY A 564
PRO A 566
GLU A 294
GLY A 332
LEU A 259
 SFG  A 700 ( 4.6A)
None
None
None
None
 1.25A 1jzsA-4onqA:
undetectable		 1jzsA-4onqA:
17.47
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.
4oud TYROSYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF00579
(tRNA-synt_1b) 		7 GLY B  39
HIS B  48
HIS B  51
GLY B 198
ASP B 200
GLN B 201
ILE B 228
 GLY  B  39 ( 0.0A)
HIS  B  48 ( 1.0A)
HIS  B  51 ( 1.0A)
GLY  B 198 ( 0.0A)
ASP  B 200 ( 0.6A)
GLN  B 201 ( 0.6A)
ILE  B 228 ( 0.7A)
 0.67A 1jzsA-4oudB:
1.1		 1jzsA-4oudB:
19.13
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.
4qi7 CELLOBIOSE
DEHYDROGENASE

(Neurospora
crassa) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C)
PF16010
(CDH-cyt) 		5 GLY A 184
GLY A  72
GLN A 182
LEU A  79
ILE A  80
 None
None
HEM  A 901 ( 4.7A)
HEM  A 901 (-3.2A)
None
 1.17A 1jzsA-4qi7A:
undetectable		 1jzsA-4qi7A:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rzz PEPTIDASE M24

(Ruegeria
lacuscaerulensis) 		PF00557
(Peptidase_M24) 		5 GLY A 208
PRO A 209
GLU A 211
ASP A  88
ILE A 299
 None
 1.17A 1jzsA-4rzzA:
undetectable		 1jzsA-4rzzA:
20.32
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.
4wso PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Burkholderia
thailandensis) 		PF01467
(CTP_transf_like) 		5 GLY A  35
HIS A  42
HIS A  45
GLY A 136
ASP A 138
 NAD  A 301 (-3.2A)
PO4  A 302 ( 4.2A)
PO4  A 302 ( 4.0A)
NAD  A 301 (-3.1A)
NAD  A 301 (-2.9A)
 0.80A 1jzsA-4wsoA:
undetectable		 1jzsA-4wsoA:
15.96
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.
4wso PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Burkholderia
thailandensis) 		PF01467
(CTP_transf_like) 		5 GLY A  35
HIS A  45
GLY A 136
ASP A 138
GLN A 139
 NAD  A 301 (-3.2A)
PO4  A 302 ( 4.0A)
NAD  A 301 (-3.1A)
NAD  A 301 (-2.9A)
NAD  A 301 (-3.7A)
 1.04A 1jzsA-4wsoA:
undetectable		 1jzsA-4wsoA:
15.96
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.
4zpj EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Sphaerobacter
thermophilus) 		PF13458
(Peripla_BP_6) 		5 GLY A 263
PRO A 264
HIS A 283
HIS A 224
GLN A 295
 ZN  A 505 ( 4.4A)
None
None
None
None
 1.25A 1jzsA-4zpjA:
undetectable		 1jzsA-4zpjA:
19.86
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.
5db4 NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Mycobacteroides
abscessus) 		PF01467
(CTP_transf_like) 		5 GLY A  12
HIS A  19
HIS A  22
GLY A 110
ASP A 112
 None
ATP  A 301 (-4.0A)
ATP  A 301 (-4.0A)
ATP  A 301 (-3.0A)
ATP  A 301 (-3.2A)
 0.87A 1jzsA-5db4A:
undetectable		 1jzsA-5db4A:
14.48
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.
5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		5 GLY A  40
HIS A  48
GLY A 179
ASP A 181
GLN A 182
 5BX  A 401 (-3.9A)
ATP  A 402 (-4.0A)
ATP  A 402 (-3.0A)
ATP  A 402 (-2.9A)
5BX  A 401 ( 3.0A)
 0.84A 1jzsA-5ekdA:
6.0		 1jzsA-5ekdA:
17.78
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.
5hnp ABC TRANSPORTER

(Raoultella
ornithinolytica) 		PF14524
(Wzt_C) 		5 GLY A 429
HIS A 432
GLY A 391
LEU A 323
ILE A 324
 None
 1.25A 1jzsA-5hnpA:
undetectable		 1jzsA-5hnpA:
12.31
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.
5hy5 TRYPTOPHAN
6-HALOGENASE

(Streptomyces
toxytricini) 		PF04820
(Trp_halogenase) 		5 GLY A 299
HIS A 177
GLU A  50
GLY A  49
ILE A  56
 None
None
None
FAD  A 601 (-3.3A)
None
 1.14A 1jzsA-5hy5A:
0.6		 1jzsA-5hy5A:
20.93
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.
5ihx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL

(Aspergillus
nidulans) 		PF00579
(tRNA-synt_1b) 		5 GLY A 129
HIS A 138
HIS A 141
GLY A 297
ASP A 299
 TYR  A 501 (-3.5A)
None
None
None
None
 0.92A 1jzsA-5ihxA:
undetectable		 1jzsA-5ihxA:
18.67
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.
5ihx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL

(Aspergillus
nidulans) 		PF00579
(tRNA-synt_1b) 		6 GLY A 129
HIS A 141
GLY A 297
ASP A 299
GLN A 300
LEU A 341
 TYR  A 501 (-3.5A)
None
None
None
TYR  A 501 (-2.9A)
None
 0.78A 1jzsA-5ihxA:
undetectable		 1jzsA-5ihxA:
18.67
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.
5ijx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL

(Coccidioides
posadasii) 		PF00579
(tRNA-synt_1b) 		6 GLY A 116
HIS A 125
HIS A 128
GLY A 284
ASP A 286
GLN A 287
 TYR  A 501 (-3.6A)
None
None
None
None
TYR  A 501 (-2.8A)
 0.76A 1jzsA-5ijxA:
undetectable		 1jzsA-5ijxA:
18.50
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.
5ijx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL

(Coccidioides
posadasii) 		PF00579
(tRNA-synt_1b) 		6 HIS A 125
HIS A 128
GLY A 284
ASP A 286
GLN A 287
LEU A 330
 None
None
None
None
TYR  A 501 (-2.8A)
None
 0.86A 1jzsA-5ijxA:
undetectable		 1jzsA-5ijxA:
18.50
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.
5jxl FLAGELLAR HOOK
PROTEIN FLGE

(Campylobacter
jejuni) 		PF00460
(Flg_bb_rod)
PF06429
(Flg_bbr_C)
PF07196
(Flagellin_IN)
PF07559
(FlaE) 		5 GLY A 444
PRO A 446
GLY A 199
ASP A 209
ILE A 436
 None
 1.11A 1jzsA-5jxlA:
2.2		 1jzsA-5jxlA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k8c 3-DEOXY-ALPHA-D-MANN
O-OCTULOSONATE
8-OXIDASE

(Shewanella
oneidensis) 		PF00465
(Fe-ADH) 		5 GLY A 145
HIS A 272
SER A 248
GLY A 192
ILE A 274
 None
ZN  A 407 (-3.3A)
None
None
CL  A 404 (-4.5A)
 0.99A 1jzsA-5k8cA:
undetectable		 1jzsA-5k8cA:
18.92
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.
5tpz GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		5 GLY D 147
PRO D 148
GLY D 125
GLN D 145
ILE D 300
 None
 1.26A 1jzsA-5tpzD:
undetectable		 1jzsA-5tpzD:
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.
5vmt GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Neisseria
gonorrhoeae) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 PRO A 236
GLY A 182
ASP A 183
GLN A 184
ILE A  13
 None
None
None
None
NAD  A 401 (-4.2A)
 1.17A 1jzsA-5vmtA:
undetectable		 1jzsA-5vmtA:
16.85
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.
5x3d PHOSPHOENOLPYRUVATE
PHOSPHOMUTASE

(Streptomyces
wedmorensis) 		PF01467
(CTP_transf_like) 		5 GLY A   9
HIS A  16
HIS A  19
GLY A  92
ASP A  94
 7XL  A 201 ( 4.5A)
7XL  A 201 (-4.4A)
7XL  A 201 (-4.5A)
7XL  A 201 (-3.0A)
7XL  A 201 (-3.2A)
 0.65A 1jzsA-5x3dA:
undetectable		 1jzsA-5x3dA:
11.37
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.
5ybp PRHA

(Penicillium
brasilianum) 		no annotation 5 GLY A 146
SER A 141
GLY A 210
GLN A 133
ILE A 233
 None
 1.26A 1jzsA-5ybpA:
undetectable		 1jzsA-5ybpA:
6.59
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.
6apj ALPHA-N-ACETYLGALACT
OSAMINIDE
ALPHA-2,6-SIALYLTRAN
SFERASE 2

(Homo sapiens) 		no annotation 5 GLY A 166
PRO A 167
HIS A 172
GLN A 165
LEU A 371
 None
 1.14A 1jzsA-6apjA:
undetectable		 1jzsA-6apjA:
8.59
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.
6bqy TYROSINE--TRNA
LIGASE

(Acinetobacter
baumannii) 		no annotation 6 GLY A  48
HIS A  57
HIS A  60
GLY A 197
ASP A 199
GLN A 200
 EDO  A 501 (-3.6A)
None
None
None
None
None
 0.93A 1jzsA-6bqyA:
2.1		 1jzsA-6bqyA:
7.32
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.
6cbp DH270.6 SINGLE CHAIN
VARIABLE FRAGMENT
MAN9-V3 GLYCOPEPTIDE

(Homo sapiens;
Human
immunodeficiency
virus 1) 		no annotation 5 GLY A 237
HIS A  35
SER A 173
GLY P 324
ASP A 107
 NAG  P 401 (-3.7A)
None
None
None
None
 1.11A 1jzsA-6cbpA:
undetectable		 1jzsA-6cbpA:
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.
6eoq DIPEPTIDYL PEPTIDASE
9

(Homo sapiens) 		no annotation 5 GLY A 686
HIS A 424
GLU A 495
GLN A 684
ILE A 504
 None
 1.22A 1jzsA-6eoqA:
undetectable		 1jzsA-6eoqA:
8.93