SIMILAR PATTERNS OF AMINO ACIDS FOR 6GNG_A_QPSA601_2

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e33 ARYLSULFATASE A

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		5 GLY P  98
TYR P 149
PRO P 192
GLU P 481
GLY P 480
 None
 1.35A 6gngA-1e33P:
undetectable		 6gngA-1e33P:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e4o MALTODEXTRIN
PHOSPHORYLASE

(Escherichia
coli) 		PF00343
(Phosphorylase) 		7 GLU A  67
GLY A 114
HIS A 345
VAL A 420
ARG A 534
GLU A 637
GLY A 640
 GLC  A 997 (-3.3A)
PLP  A 999 ( 3.6A)
GLC  A 998 (-4.3A)
None
GLC  A 996 (-4.1A)
GLC  A 998 (-3.6A)
PLP  A 999 ( 3.2A)
 0.74A 6gngA-1e4oA:
23.1		 6gngA-1e4oA:
23.05
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.
1e4o MALTODEXTRIN
PHOSPHORYLASE

(Escherichia
coli) 		PF00343
(Phosphorylase) 		7 GLU A  67
GLY A 114
TYR A 256
HIS A 345
VAL A 420
GLU A 637
GLY A 640
 GLC  A 997 (-3.3A)
PLP  A 999 ( 3.6A)
GLC  A 996 (-3.8A)
GLC  A 998 (-4.3A)
None
GLC  A 998 (-3.6A)
PLP  A 999 ( 3.2A)
 0.78A 6gngA-1e4oA:
23.1		 6gngA-1e4oA:
23.05
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.
1euz GLUTAMATE
DEHYDROGENASE

(Thermococcus
profundus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 GLY A  71
PRO A 321
VAL A  59
GLU A  78
GLY A 107
 SO4  A 601 ( 4.7A)
None
None
None
None
 1.33A 6gngA-1euzA:
undetectable		 6gngA-1euzA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gqj ALPHA-D-GLUCURONIDAS
E

(Cellvibrio
japonicus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		5 GLY A 557
HIS A 549
TYR A 547
ARG A 560
GLY A 518
 None
 1.25A 6gngA-1gqjA:
2.4		 6gngA-1gqjA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i8t UDP-GALACTOPYRANOSE
MUTASE

(Escherichia
coli) 		PF03275
(GLF)
PF13450
(NAD_binding_8) 		5 GLY A 231
TYR A 239
TYR A 325
VAL A 335
GLY A 338
 FAD  A 450 (-3.5A)
None
None
None
None
 1.40A 6gngA-1i8tA:
2.5		 6gngA-1i8tA:
20.68
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.
1itk CATALASE-PEROXIDASE

(Haloarcula
marismortui) 		PF00141
(peroxidase) 		5 GLY A 109
TYR A 218
VAL A 185
ARG A 409
GLY A 106
 None
 1.31A 6gngA-1itkA:
undetectable		 6gngA-1itkA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1itk CATALASE-PEROXIDASE

(Haloarcula
marismortui) 		PF00141
(peroxidase) 		5 GLY A 262
TYR A 322
VAL A 354
PRO A 366
GLY A 309
 HEM  A 800 (-3.3A)
None
None
None
None
 1.37A 6gngA-1itkA:
undetectable		 6gngA-1itkA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rw1 CONSERVED
HYPOTHETICAL PROTEIN
YFFB

(Pseudomonas
aeruginosa) 		PF03960
(ArsC) 		5 GLU A  49
GLY A  99
TYR A   6
PRO A  87
ARG A  45
 None
 1.38A 6gngA-1rw1A:
undetectable		 6gngA-1rw1A:
12.06
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.
1rzv GLYCOGEN SYNTHASE 1

(Agrobacterium
tumefaciens) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 GLU A   9
GLY A  18
HIS A 163
VAL A 213
PRO A 377
 None
 0.72A 6gngA-1rzvA:
40.5		 6gngA-1rzvA:
28.46
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.
1rzv GLYCOGEN SYNTHASE 1

(Agrobacterium
tumefaciens) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		6 GLU A   9
GLY A  18
TYR A  96
TRP A 139
HIS A 163
VAL A 213
 None
 0.52A 6gngA-1rzvA:
40.5		 6gngA-1rzvA:
28.46
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.
1s2n EXTRACELLULAR
SUBTILISIN-LIKE
SERINE PROTEINASE

(Vibrio sp.
PA-44) 		PF00082
(Peptidase_S8) 		5 GLU A  46
GLY A  79
TYR A 213
PRO A 224
GLY A 228
 None
 1.02A 6gngA-1s2nA:
4.0		 6gngA-1s2nA:
20.03
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.
1s2n EXTRACELLULAR
SUBTILISIN-LIKE
SERINE PROTEINASE

(Vibrio sp.
PA-44) 		PF00082
(Peptidase_S8) 		5 GLU A  46
GLY A  79
TYR A 213
VAL A  35
PRO A 224
 None
 1.20A 6gngA-1s2nA:
4.0		 6gngA-1s2nA:
20.03
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.
1s2n EXTRACELLULAR
SUBTILISIN-LIKE
SERINE PROTEINASE

(Vibrio sp.
PA-44) 		PF00082
(Peptidase_S8) 		5 GLU A  46
GLY A  84
TYR A 213
PRO A 224
GLY A 228
 None
 1.42A 6gngA-1s2nA:
4.0		 6gngA-1s2nA:
20.03
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.
1ygp YEAST GLYCOGEN
PHOSPHORYLASE

(Saccharomyces
cerevisiae) 		PF00343
(Phosphorylase) 		7 GLU A  88
GLY A 135
TYR A 280
HIS A 377
VAL A 455
ARG A 569
GLU A 672
 None
PLP  A 860 ( 3.3A)
None
None
None
PO4  A1900 (-3.7A)
None
 0.87A 6gngA-1ygpA:
20.7		 6gngA-1ygpA:
21.16
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.
1ygp YEAST GLYCOGEN
PHOSPHORYLASE

(Saccharomyces
cerevisiae) 		PF00343
(Phosphorylase) 		7 GLU A  88
GLY A 135
TYR A 280
HIS A 377
VAL A 455
ARG A 569
GLY A 675
 None
PLP  A 860 ( 3.3A)
None
None
None
PO4  A1900 (-3.7A)
PLP  A 860 ( 4.1A)
 0.86A 6gngA-1ygpA:
20.7		 6gngA-1ygpA:
21.16
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.
1zx5 MANNOSEPHOSPHATE
ISOMERASE, PUTATIVE

(Archaeoglobus
fulgidus) 		PF01238
(PMI_typeI) 		5 GLU A 255
GLY A 290
TYR A 164
VAL A 285
GLY A 238
 None
None
ACY  A 502 (-4.5A)
None
None
 1.13A 6gngA-1zx5A:
undetectable		 6gngA-1zx5A:
20.68
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.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		5 GLU A  67
GLY A 114
TYR A 245
HIS A 334
GLU A 626
 None
PO4  A1794 (-3.4A)
None
FMT  A1799 (-3.9A)
None
 0.82A 6gngA-2c4mA:
22.4		 6gngA-2c4mA:
23.46
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.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		6 GLU A  67
GLY A 114
TYR A 245
HIS A 334
VAL A 408
GLY A 629
 None
PO4  A1794 (-3.4A)
None
FMT  A1799 (-3.9A)
None
PLP  A1634 ( 3.8A)
 0.87A 6gngA-2c4mA:
22.4		 6gngA-2c4mA:
23.46
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.
2e6k TRANSKETOLASE

(Thermus
thermophilus) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLU A 493
GLY A 550
TYR A 534
HIS A 554
PRO A 542
 None
 1.16A 6gngA-2e6kA:
2.2		 6gngA-2e6kA:
23.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fkb PUTATIVE NUDIX
HYDROLASE YFCD

(Escherichia
coli) 		PF00293
(NUDIX) 		5 GLY A  73
TRP A 116
HIS A  37
VAL A  12
GLU A  79
 GOL  A 904 (-3.3A)
None
None
None
None
 1.36A 6gngA-2fkbA:
undetectable		 6gngA-2fkbA:
15.74
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.
2gj4 GLYCOGEN
PHOSPHORYLASE,
MUSCLE FORM

(Oryctolagus
cuniculus) 		PF00343
(Phosphorylase) 		6 GLU A  88
GLY A 135
HIS A 377
VAL A 455
GLU A 672
GLY A 675
 None
PLR  A 940 ( 3.8A)
None
None
PLR  A 940 ( 4.5A)
PLR  A 940 (-3.3A)
 0.72A 6gngA-2gj4A:
21.8		 6gngA-2gj4A:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gsn PHOSPHODIESTERASE-NU
CLEOTIDE
PYROPHOSPHATASE

(Xanthomonas
citri) 		PF01663
(Phosphodiest) 		5 GLU A 160
GLY A 158
TRP A 154
TYR A 205
VAL A  98
 None
 1.34A 6gngA-2gsnA:
undetectable		 6gngA-2gsnA:
21.90
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.
2hnh DNA POLYMERASE III
ALPHA SUBUNIT

(Escherichia
coli) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		5 GLY A 509
TYR A  15
PRO A  26
VAL A 538
GLY A 513
 None
 1.21A 6gngA-2hnhA:
undetectable		 6gngA-2hnhA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ixo SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
ACTIVATOR 1

(Saccharomyces
cerevisiae) 		PF03095
(PTPA) 		5 TYR A 248
HIS A 209
PRO A  55
VAL A 295
GLY A 145
 None
 1.14A 6gngA-2ixoA:
undetectable		 6gngA-2ixoA:
19.16
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.
2nlx XYLULOSE KINASE

(Escherichia
coli) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 GLU A 204
HIS A 279
VAL A 262
GLU A 264
GLY A 265
 None
 1.43A 6gngA-2nlxA:
undetectable		 6gngA-2nlxA:
23.24
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.
2ogs THERMOSTABLE
CARBOXYLESTERASE
EST50

(Geobacillus
stearothermophilus) 		PF00135
(COesterase) 		5 GLY A 163
TYR A  29
VAL A 283
ARG A 139
GLY A 160
 GLY  A 163 ( 0.0A)
TYR  A  29 ( 1.3A)
VAL  A 283 ( 0.6A)
ARG  A 139 ( 0.6A)
GLY  A 160 ( 0.0A)
 1.01A 6gngA-2ogsA:
5.4		 6gngA-2ogsA:
22.48
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.
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		5 GLY A 336
TYR A 290
TRP A  14
HIS A 325
VAL A  55
 None
None
None
ZN  A1515 ( 3.2A)
None
 1.37A 6gngA-2w8sA:
undetectable		 6gngA-2w8sA:
22.31
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.
2xd3 MALTOSE/MALTODEXTRIN
-BINDING PROTEIN

(Streptococcus
pneumoniae) 		PF13416
(SBP_bac_8) 		5 GLU A 342
TYR A  51
TRP A 308
PRO A  94
GLY A 303
 GLC  A1417 ( 4.7A)
GLC  A1417 (-4.9A)
None
None
None
 1.20A 6gngA-2xd3A:
undetectable		 6gngA-2xd3A:
26.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xmr PROTEIN NDRG2

(Homo sapiens) 		PF03096
(Ndr) 		5 GLU A 291
GLY A 287
TYR A 295
PRO A 242
PRO A 281
 None
 1.38A 6gngA-2xmrA:
5.8		 6gngA-2xmrA:
17.32
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.
2xt6 2-OXOGLUTARATE
DECARBOXYLASE

(Mycolicibacterium
smegmatis) 		PF00198
(2-oxoacid_dh)
PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C) 		5 GLY A 746
HIS A 747
ARG A 745
GLU A 749
GLY A 750
 None
TPP  A2001 (-4.5A)
None
None
None
 1.35A 6gngA-2xt6A:
undetectable		 6gngA-2xt6A:
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.
2y6g XYLANASE

(Rhodothermus
marinus) 		PF02018
(CBM_4_9) 		5 GLY A 148
PRO A  51
VAL A  32
PRO A  40
GLY A  63
 None
 1.26A 6gngA-2y6gA:
undetectable		 6gngA-2y6gA:
14.75
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.
3c1a PUTATIVE
OXIDOREDUCTASE

(Magnetospirillum
magnetotacticum) 		PF01408
(GFO_IDH_MocA) 		5 GLU A 125
TYR A  24
HIS A 126
VAL A 306
GLY A 172
 None
 1.42A 6gngA-3c1aA:
3.9		 6gngA-3c1aA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cem GLYCOGEN
PHOSPHORYLASE, LIVER
FORM

(Homo sapiens) 		PF00343
(Phosphorylase) 		6 GLU A  88
GLY A 135
HIS A 377
VAL A 455
GLU A 672
GLY A 675
 None
PLP  A 832 (-3.9A)
NBG  A   1 (-3.8A)
NBG  A   1 ( 4.5A)
NBG  A   1 (-3.5A)
PLP  A 832 ( 3.3A)
 0.64A 6gngA-3cemA:
22.2		 6gngA-3cemA:
22.17
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		7 GLU A   9
GLY A  18
TYR A  95
TRP A 138
HIS A 161
TYR A 165
VAL A 211
 None
 0.75A 6gngA-3d1jA:
40.8		 6gngA-3d1jA:
29.94
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 GLY A  18
TRP A 138
TYR A 165
VAL A 211
PRO A 378
 None
 0.94A 6gngA-3d1jA:
40.8		 6gngA-3d1jA:
29.94
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 TRP A 138
HIS A 161
TYR A 165
VAL A 211
GLY A 380
 None
 0.92A 6gngA-3d1jA:
40.8		 6gngA-3d1jA:
29.94
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 TRP A 138
TYR A 165
VAL A 211
PRO A 378
GLY A 380
 None
 1.24A 6gngA-3d1jA:
40.8		 6gngA-3d1jA:
29.94
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.
3d3a BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01301
(Glyco_hydro_35) 		5 GLY A 469
HIS A 307
PRO A 607
VAL A 508
GLU A 466
 None
 1.24A 6gngA-3d3aA:
undetectable		 6gngA-3d3aA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dkh LACCASE-1

(Melanocarpus
albomyces) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLY A 299
TYR A 176
HIS A 237
PRO A  49
GLY A 293
 None
 1.26A 6gngA-3dkhA:
undetectable		 6gngA-3dkhA:
21.43
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.
3dv9 BETA-PHOSPHOGLUCOMUT
ASE

(Bacteroides
vulgatus) 		PF13419
(HAD_2) 		5 GLY A  63
HIS A  61
TYR A  59
PRO A 189
GLY A 191
 PO4  A 302 (-3.6A)
None
EDO  A 303 (-4.8A)
None
None
 1.29A 6gngA-3dv9A:
6.0		 6gngA-3dv9A:
17.69
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.
3ica PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Porphyromonas
gingivalis) 		no annotation 5 GLU A  68
GLY A  66
TYR A  33
GLU A 203
GLY A 113
 GOL  A 211 (-3.0A)
None
None
None
None
 1.36A 6gngA-3icaA:
undetectable		 6gngA-3icaA:
17.28
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.
3iuk UNCHARACTERIZED
PROTEIN

(Paenarthrobacter
aurescens) 		PF05960
(DUF885) 		5 GLY A 390
PRO A 368
VAL A 395
GLU A 420
GLY A 419
 None
None
None
MG  A 560 ( 3.9A)
None
 1.28A 6gngA-3iukA:
undetectable		 6gngA-3iukA:
24.18
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.
3ix1 N-FORMYL-4-AMINO-5-A
MINOMETHYL-2-METHYLP
YRIMIDINE BINDING
PROTEIN

(Bacillus
halodurans) 		PF09084
(NMT1) 		5 TYR A  90
HIS A 191
PRO A 214
VAL A 195
GLY A 173
 NFM  A 401 (-3.9A)
NFM  A 401 ( 4.4A)
None
None
None
 1.19A 6gngA-3ix1A:
undetectable		 6gngA-3ix1A:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3juj UDP-GLUCOSE
PYROPHOSPHORYLASE
(GALU)

(Helicobacter
pylori) 		PF00483
(NTP_transferase) 		5 GLY A 107
TYR A 207
VAL A  54
PRO A   8
GLY A  11
 None
 1.29A 6gngA-3jujA:
2.3		 6gngA-3jujA:
17.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l01 GLGA GLYCOGEN
SYNTHASE

(Pyrococcus
abyssi) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		6 GLU A   9
GLY A  17
TYR A  89
TRP A 129
HIS A 151
PRO A 340
 None
CL  A5703 (-4.7A)
GOL  A6500 ( 3.9A)
GOL  A6502 (-4.3A)
None
K  A5600 ( 4.8A)
 0.85A 6gngA-3l01A:
34.6		 6gngA-3l01A:
26.28
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.
3l01 GLGA GLYCOGEN
SYNTHASE

(Pyrococcus
abyssi) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		7 GLU A   9
TYR A  89
TRP A 129
HIS A 151
VAL A 193
GLU A 339
PRO A 340
 None
GOL  A6500 ( 3.9A)
GOL  A6502 (-4.3A)
None
None
K  A5600 (-4.0A)
K  A5600 ( 4.8A)
 0.74A 6gngA-3l01A:
34.6		 6gngA-3l01A:
26.28
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.
3l01 GLGA GLYCOGEN
SYNTHASE

(Pyrococcus
abyssi) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		7 TYR A  89
TRP A 129
HIS A 151
VAL A 193
GLU A 339
PRO A 340
GLY A 342
 GOL  A6500 ( 3.9A)
GOL  A6502 (-4.3A)
None
None
K  A5600 (-4.0A)
K  A5600 ( 4.8A)
K  A5600 (-4.4A)
 0.93A 6gngA-3l01A:
34.6		 6gngA-3l01A:
26.28
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.
3m07 PUTATIVE ALPHA
AMYLASE

(Salmonella
enterica) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 GLY A 205
TRP A 161
PRO A 472
GLU A 207
GLY A 208
 None
 1.41A 6gngA-3m07A:
undetectable		 6gngA-3m07A:
22.90
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.
3mn1 PROBABLE YRBI FAMILY
PHOSPHATASE

(Pseudomonas
savastanoi) 		PF08282
(Hydrolase_3) 		5 GLY A  31
VAL A 133
ARG A  32
GLU A 154
GLY A 153
 None
 1.24A 6gngA-3mn1A:
5.1		 6gngA-3mn1A:
15.03
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.
3qe7 URACIL PERMEASE

(Escherichia
coli) 		PF00860
(Xan_ur_permease) 		5 HIS A  24
PRO A 216
VAL A 294
GLU A 290
GLY A 289
 None
None
None
URA  A 430 (-2.6A)
BNG  A 431 ( 3.0A)
 1.40A 6gngA-3qe7A:
undetectable		 6gngA-3qe7A:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s29 SUCROSE SYNTHASE 1

(Arabidopsis
thaliana) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 GLY A 288
TYR A 392
PRO A 408
VAL A 295
GLY A 302
 None
None
None
None
FRU  A 902 ( 2.2A)
 1.43A 6gngA-3s29A:
16.4		 6gngA-3s29A:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s29 SUCROSE SYNTHASE 1

(Arabidopsis
thaliana) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 GLY A 303
HIS A 438
ARG A 580
GLU A 675
GLY A 678
 UDP  A 901 ( 2.9A)
None
FRU  A 902 ( 3.7A)
UDP  A 901 (-4.1A)
UDP  A 901 ( 3.7A)
 0.61A 6gngA-3s29A:
16.4		 6gngA-3s29A:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sgg HYPOTHETICAL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF14323
(GxGYxYP_C)
PF16216
(GxGYxYP_N) 		5 GLY A 456
TYR A 394
VAL A 478
GLU A 474
GLY A 459
 None
GOL  A 558 (-4.4A)
None
None
None
 1.34A 6gngA-3sggA:
2.6		 6gngA-3sggA:
21.47
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.
3ulk KETOL-ACID
REDUCTOISOMERASE

(Escherichia
coli) 		PF01450
(IlvC)
PF07991
(IlvN) 		5 GLY A 204
TRP A 194
HIS A 201
GLU A  27
GLY A  24
 GLY  A 204 ( 0.0A)
TRP  A 194 ( 0.5A)
HIS  A 201 (-1.0A)
GLU  A  27 ( 0.6A)
GLY  A  24 ( 0.0A)
 1.18A 6gngA-3ulkA:
3.8		 6gngA-3ulkA:
21.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vue GRANULE-BOUND STARCH
SYNTHASE 1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Oryza sativa) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		9 GLU A  91
GLY A  99
TRP A 235
HIS A 264
VAL A 321
ARG A 408
GLU A 485
PRO A 486
GLY A 488
 None
SO4  A 704 (-3.2A)
SO4  A 701 ( 4.8A)
None
None
SO4  A 704 (-3.7A)
None
None
None
 1.04A 6gngA-3vueA:
47.9		 6gngA-3vueA:
46.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vue GRANULE-BOUND STARCH
SYNTHASE 1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Oryza sativa) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		8 GLU A  91
GLY A 100
TRP A 235
HIS A 264
TYR A 268
VAL A 321
ARG A 408
GLY A 488
 None
SO4  A 704 (-4.1A)
SO4  A 701 ( 4.8A)
None
SO4  A 701 (-4.8A)
None
SO4  A 704 (-3.7A)
None
 0.85A 6gngA-3vueA:
47.9		 6gngA-3vueA:
46.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vue GRANULE-BOUND STARCH
SYNTHASE 1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Oryza sativa) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		9 GLU A  91
GLY A 100
TRP A 235
HIS A 264
VAL A 321
ARG A 408
GLU A 485
PRO A 486
GLY A 488
 None
SO4  A 704 (-4.1A)
SO4  A 701 ( 4.8A)
None
None
SO4  A 704 (-3.7A)
None
None
None
 0.63A 6gngA-3vueA:
47.9		 6gngA-3vueA:
46.45
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.
4ako SPORE COAT PROTEIN A

(Bacillus
subtilis) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 HIS A 491
PRO A 222
VAL A 489
PRO A 119
GLY A 117
 CU  A 603 ( 3.1A)
None
None
None
None
 1.14A 6gngA-4akoA:
undetectable		 6gngA-4akoA:
22.17
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.
4bqi ALPHA-GLUCAN
PHOSPHORYLASE 2,
CYTOSOLIC

(Arabidopsis
thaliana) 		PF00343
(Phosphorylase) 		7 GLU A  91
GLY A 138
TYR A 285
HIS A 379
VAL A 458
ARG A 573
GLU A 679
 None
PLP  A 901 (-3.3A)
None
None
None
None
None
 0.86A 6gngA-4bqiA:
22.3		 6gngA-4bqiA:
22.87
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.
4bqi ALPHA-GLUCAN
PHOSPHORYLASE 2,
CYTOSOLIC

(Arabidopsis
thaliana) 		PF00343
(Phosphorylase) 		7 GLU A  91
GLY A 138
TYR A 285
HIS A 379
VAL A 458
ARG A 573
GLY A 682
 None
PLP  A 901 (-3.3A)
None
None
None
None
PLP  A 901 (-3.5A)
 0.89A 6gngA-4bqiA:
22.3		 6gngA-4bqiA:
22.87
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.
4dkn AMPHIOXUS GREEN
FLUORESCENT PROTEIN,
GFPA1

(Branchiostoma
floridae) 		PF01353
(GFP) 		5 GLY A  26
HIS A 110
TYR A 104
PRO A   4
GLY A  28
 None
None
CR2  A  60 ( 4.5A)
None
None
 1.14A 6gngA-4dknA:
undetectable		 6gngA-4dknA:
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.
4dxb MALTOSE-BINDING
PERIPLASMIC PROTEIN,
BETA-LACTAMASE TEM
CHIMERA

(Escherichia
coli) 		PF01547
(SBP_bac_1)
PF13354
(Beta-lactamase2) 		5 GLU A 308
GLY A 300
TYR A  90
VAL A 244
GLY A 228
 None
 1.34A 6gngA-4dxbA:
undetectable		 6gngA-4dxbA:
24.24
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.
4gyp GLUCARATE
DEHYDRATASE-RELATED
PROTEIN

(Escherichia
coli) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY C 212
VAL C 233
ARG C 445
PRO C 235
GLY C 208
 None
 1.19A 6gngA-4gypC:
undetectable		 6gngA-4gypC:
23.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l22 PHOSPHORYLASE

(Streptococcus
mutans) 		PF00343
(Phosphorylase) 		6 GLU A  58
GLY A 105
TYR A 228
HIS A 317
ARG A 498
GLU A 600
 None
 0.78A 6gngA-4l22A:
23.1		 6gngA-4l22A:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l22 PHOSPHORYLASE

(Streptococcus
mutans) 		PF00343
(Phosphorylase) 		7 GLU A  58
GLY A 105
TYR A 228
HIS A 317
VAL A 384
ARG A 498
GLY A 603
 None
 0.89A 6gngA-4l22A:
23.1		 6gngA-4l22A:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p1l TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Chromohalobacter
salexigens) 		PF03480
(DctP) 		5 GLY A 154
TYR A 234
ARG A 156
GLU A 244
GLY A 152
 None
None
BDP  A 401 (-3.0A)
BDP  A 401 (-3.0A)
None
 1.41A 6gngA-4p1lA:
undetectable		 6gngA-4p1lA:
21.62
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.
4pqg GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
pneumoniae) 		PF00534
(Glycos_transf_1) 		6 GLU A  18
GLY A  16
HIS A 242
ARG A 328
GLU A 404
GLY A 407
 None
UDP  A 601 ( 3.0A)
NAG  A 602 (-3.9A)
UDP  A 601 (-3.8A)
NAG  A 602 (-3.6A)
UDP  A 601 ( 3.4A)
 0.76A 6gngA-4pqgA:
17.3		 6gngA-4pqgA:
23.32
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.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		6 GLU A  52
GLY A  59
TRP A 200
HIS A 223
VAL A 276
PRO A 532
 None
 0.73A 6gngA-4qlbA:
18.7		 6gngA-4qlbA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		6 GLU A  52
TRP A 200
HIS A 223
VAL A 276
PRO A 532
GLY A 534
 None
 0.89A 6gngA-4qlbA:
18.7		 6gngA-4qlbA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		5 HIS A 223
VAL A 276
GLU A 531
PRO A 532
GLY A 534
 None
 1.15A 6gngA-4qlbA:
18.7		 6gngA-4qlbA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xsr ALR3699 PROTEIN

(Nostoc sp. PCC
7120) 		no annotation 7 GLU B  16
GLY B  14
HIS B 121
ARG B 208
GLU B 288
PRO B 289
GLY B 291
 None
UPG  B 403 (-3.2A)
UPG  B 403 (-3.9A)
UPG  B 403 (-3.6A)
UPG  B 403 (-3.5A)
UPG  B 403 (-3.4A)
UPG  B 403 (-3.7A)
 0.80A 6gngA-4xsrB:
11.1		 6gngA-4xsrB:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yw5 NEURAMINIDASE C

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		5 GLU A 720
GLY A 692
TYR A 632
PRO A 656
GLY A 665
 None
 1.19A 6gngA-4yw5A:
undetectable		 6gngA-4yw5A:
21.16
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.
4zm6 N-ACETYL-BETA-D
GLUCOSAMINIDASE

(Rhizomucor
miehei) 		PF00583
(Acetyltransf_1)
PF00933
(Glyco_hydro_3) 		5 GLU A 209
GLY A 185
HIS A 184
PRO A 144
GLY A 147
 None
 1.42A 6gngA-4zm6A:
5.0		 6gngA-4zm6A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ah0 LIPASE

(Pelosinus
fermentans) 		no annotation 5 TYR A  87
TRP A 220
ARG A 102
GLU A  34
GLY A  31
 None
 1.42A 6gngA-5ah0A:
5.3		 6gngA-5ah0A:
19.49
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.
5ah1 TRIACYLGLYCEROL
LIPASE

(Clostridium
botulinum) 		no annotation 5 TYR A 146
TRP A 274
ARG A 161
GLU A  93
GLY A  90
 None
 1.32A 6gngA-5ah1A:
4.9		 6gngA-5ah1A:
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.
5b0s LIN0857 PROTEIN

(Listeria
innocua) 		PF04041
(Glyco_hydro_130) 		5 GLY A 245
TYR A 264
PRO A 253
GLU A 241
GLY A 240
 None
 1.41A 6gngA-5b0sA:
undetectable		 6gngA-5b0sA:
20.06
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.
5d01 N-ACETYL-ALPHA-D-GLU
COSAMINYL L-MALATE
SYNTHASE

(Bacillus
subtilis) 		PF00534
(Glycos_transf_1)
PF13439
(Glyco_transf_4) 		5 GLY A  16
HIS A 121
VAL A 151
GLU A 283
GLY A 286
 GMT  A 401 (-3.4A)
GMT  A 401 (-3.8A)
GMT  A 401 (-4.3A)
GMT  A 401 (-3.6A)
GMT  A 401 (-3.7A)
 0.43A 6gngA-5d01A:
28.6		 6gngA-5d01A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g0a TRANSAMINASE

(Bacillus
megaterium) 		PF00202
(Aminotran_3) 		5 GLU A 237
TRP A 266
PRO A 112
VAL A 189
GLY A 154
 PLP  A1298 (-3.9A)
None
None
None
None
 1.21A 6gngA-5g0aA:
undetectable		 6gngA-5g0aA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gms ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 GLY A  77
TYR A  73
HIS A 269
PRO A 229
VAL A 195
 None
 1.42A 6gngA-5gmsA:
6.4		 6gngA-5gmsA:
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.
5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB

(Mus musculus) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		5 GLY A 598
HIS A 602
PRO A 123
VAL A 636
GLY A 319
 None
 1.27A 6gngA-5hjrA:
undetectable		 6gngA-5hjrA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ikp GLYCOGEN
PHOSPHORYLASE, BRAIN
FORM

(Homo sapiens) 		PF00343
(Phosphorylase) 		7 GLU A  88
GLY A 135
TYR A 280
HIS A 377
VAL A 455
GLU A 672
GLY A 675
 None
PLP  A 901 ( 3.8A)
None
None
None
None
PLP  A 901 (-3.3A)
 0.78A 6gngA-5ikpA:
21.5		 6gngA-5ikpA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lrb ALPHA-1,4 GLUCAN
PHOSPHORYLASE

(Hordeum vulgare) 		PF00343
(Phosphorylase) 		8 GLU A 135
GLY A 182
TYR A 329
HIS A 421
VAL A 584
ARG A 699
GLU A 806
GLY A 809
 None
GLC  A1001 ( 3.7A)
None
GLC  A1001 (-3.7A)
None
GLC  A1001 ( 4.9A)
GLC  A1001 (-3.4A)
GLC  A1001 ( 3.6A)
 0.90A 6gngA-5lrbA:
22.4		 6gngA-5lrbA:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vnc GLYCOGEN [STARCH]
SYNTHASE ISOFORM 2

(Saccharomyces
cerevisiae) 		no annotation 7 GLU A  16
GLY A  23
TRP A 170
HIS A 193
VAL A 247
PRO A 510
GLY A 512
 None
None
None
None
None
None
UDP  A 801 (-3.5A)
 0.88A 6gngA-5vncA:
21.1		 6gngA-5vncA:
10.13
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.
5vnc GLYCOGEN [STARCH]
SYNTHASE ISOFORM 2

(Saccharomyces
cerevisiae) 		no annotation 5 HIS A 193
VAL A 247
GLU A 509
PRO A 510
GLY A 512
 None
None
UDP  A 801 (-3.9A)
None
UDP  A 801 (-3.5A)
 0.94A 6gngA-5vncA:
21.1		 6gngA-5vncA:
10.13
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.
5vws CYTOCHROME P450

(Thermobispora
bispora) 		PF00067
(p450) 		5 GLY A 346
PRO A 366
VAL A 136
PRO A 133
GLY A 231
 HEM  A 401 ( 3.1A)
None
None
None
HEM  A 401 (-2.8A)
 1.25A 6gngA-5vwsA:
undetectable		 6gngA-5vwsA:
22.17
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.
5wgx FLAVIN-DEPENDENT
HALOGENASE

(Malbranchea
aurantiaca) 		PF04820
(Trp_halogenase) 		5 GLY A  49
PRO A 270
VAL A 162
GLU A  70
GLY A  44
 None
None
None
FAD  A 701 (-2.7A)
FAD  A 701 (-3.5A)
 1.40A 6gngA-5wgxA:
3.4		 6gngA-5wgxA:
20.98
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.
5whs CATALASE-PEROXIDASE

(Neurospora
crassa) 		no annotation 5 GLY A 104
TYR A 238
VAL A 180
ARG A 426
GLY A 101
 None
TOX  A  90 ( 2.8A)
None
None
None
 1.40A 6gngA-5whsA:
undetectable		 6gngA-5whsA:
12.45
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.
5zq4 SIDE

(Legionella
pneumophila) 		no annotation 5 TYR B 421
HIS B 403
TYR B 285
VAL B 331
GLY B 275
 None
AMP  B 601 (-3.9A)
None
None
None
 1.43A 6gngA-5zq4B:
undetectable		 6gngA-5zq4B:
10.05
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.
6ejj WLAC PROTEIN

(Campylobacter
jejuni) 		no annotation 5 GLU A  18
GLY A  16
HIS A 118
ARG A 191
GLU A 267
 A2G  A 406 ( 3.1A)
UDP  A 401 (-3.0A)
CL  A 404 ( 4.5A)
UDP  A 401 (-3.5A)
NA  A 403 (-3.6A)
 1.02A 6gngA-6ejjA:
13.5		 6gngA-6ejjA:
9.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6eon BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 GLY A 469
HIS A 307
PRO A 607
VAL A 508
GLU A 466
 None
 1.17A 6gngA-6eonA:
undetectable		 6gngA-6eonA:
22.52
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.
6gne -

(-) 		no annotation 5 GLU A  33
GLY A  41
TRP A 162
TYR A 194
GLU A 412
 ACR  A 602 ( 4.6A)
ADP  A 601 ( 3.8A)
ACR  A 602 (-4.2A)
ACR  A 602 (-4.0A)
ACR  A 602 (-3.7A)
 1.28A 6gngA-6gneA:
42.2		 6gngA-6gneA:
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.
6gne -

(-) 		no annotation 11 GLU A  33
GLY A  42
TYR A 127
TRP A 162
HIS A 190
TYR A 194
VAL A 244
ARG A 332
GLU A 412
PRO A 413
GLY A 415
 ACR  A 602 ( 4.6A)
ADP  A 601 ( 3.2A)
ACR  A 602 ( 4.2A)
ACR  A 602 (-4.2A)
ACR  A 602 (-3.8A)
ACR  A 602 (-4.0A)
ACR  A 602 (-4.3A)
ACR  A 602 ( 3.7A)
ACR  A 602 (-3.7A)
ACR  A 602 (-3.5A)
ADP  A 601 ( 3.5A)
 0.51A 6gngA-6gneA:
42.2		 6gngA-6gneA:
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.
6gnf -

(-) 		no annotation 7 GLU A  10
GLY A  19
TYR A 101
PRO A 215
ARG A 338
GLU A 414
GLY A 417
 QPS  A 602 ( 4.5A)
ADP  A 601 ( 3.3A)
QPS  A 602 (-3.9A)
SO4  A 606 (-4.7A)
ADP  A 601 ( 4.1A)
QPS  A 602 (-3.6A)
QPS  A 602 (-3.7A)
 1.00A 6gngA-6gnfA:
54.4		 6gngA-6gnfA:
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.
6gnf -

(-) 		no annotation 11 GLU A  10
GLY A  19
TYR A 101
TRP A 152
HIS A 181
PRO A 216
VAL A 251
ARG A 338
GLU A 414
PRO A 415
GLY A 417
 QPS  A 602 ( 4.5A)
ADP  A 601 ( 3.3A)
QPS  A 602 (-3.9A)
SO4  A 606 ( 3.3A)
QPS  A 602 (-4.1A)
None
QPS  A 602 ( 4.6A)
ADP  A 601 ( 4.1A)
QPS  A 602 (-3.6A)
QPS  A 602 (-3.6A)
QPS  A 602 (-3.7A)
 0.34A 6gngA-6gnfA:
54.4		 6gngA-6gnfA:
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.
6gnf -

(-) 		no annotation 8 GLY A  19
HIS A 181
PRO A 225
VAL A 251
ARG A 338
GLU A 414
PRO A 415
GLY A 417
 ADP  A 601 ( 3.3A)
QPS  A 602 (-4.1A)
None
QPS  A 602 ( 4.6A)
ADP  A 601 ( 4.1A)
QPS  A 602 (-3.6A)
QPS  A 602 (-3.6A)
QPS  A 602 (-3.7A)
 0.77A 6gngA-6gnfA:
54.4		 6gngA-6gnfA:
undetectable