SIMILAR PATTERNS OF AMINO ACIDS FOR 4G77_A_TLFA711_0

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		5 ILE A 127
HIS A 246
ALA A 248
TYR A 324
ALA A 327
 None
 0.34A 4g77A-1biyA:
55.5		 4g77A-1biyA:
91.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		6 ILE A 469
LEU A 473
HIS A 588
ALA A 590
VAL A 591
TYR A 665
 None
 0.58A 4g77A-1biyA:
55.5		 4g77A-1biyA:
91.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		6 LEU A 473
HIS A 588
ALA A 590
VAL A 591
TYR A 665
ALA A 668
 None
 0.60A 4g77A-1biyA:
55.5		 4g77A-1biyA:
91.30
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.
1dbr HYPOXANTHINE GUANINE
XANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Toxoplasma
gondii) 		PF00156
(Pribosyltran) 		4 ILE A  42
ALA A 218
VAL A 217
ALA A 224
 None
 0.77A 4g77A-1dbrA:
undetectable		 4g77A-1dbrA:
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.
1dot DUCK OVOTRANSFERRIN

(Anas
platyrhynchos) 		PF00405
(Transferrin) 		4 ILE A 127
ALA A 245
TYR A 324
ALA A 327
 None
 0.31A 4g77A-1dotA:
41.0		 4g77A-1dotA:
28.24
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.
1dot DUCK OVOTRANSFERRIN

(Anas
platyrhynchos) 		PF00405
(Transferrin) 		5 ILE A 466
LEU A 470
HIS A 585
ALA A 587
TYR A 661
 None
NAG  A 691 (-4.2A)
None
None
None
 0.48A 4g77A-1dotA:
41.0		 4g77A-1dotA:
28.24
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.
1eks MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
C

(Escherichia
coli) 		PF01967
(MoaC) 		4 ILE A  99
LEU A  88
ALA A 122
VAL A 121
 None
 0.72A 4g77A-1eksA:
undetectable		 4g77A-1eksA:
18.02
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.
1f4h BETA-GALACTOSIDASE

(Escherichia
coli) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		4 ILE A 351
LEU A 349
ALA A 386
VAL A 387
 None
 0.71A 4g77A-1f4hA:
undetectable		 4g77A-1f4hA:
15.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f8w NADH PEROXIDASE

(Enterococcus
faecalis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 ILE A 263
LEU A 255
ALA A 278
VAL A 279
 None
 0.56A 4g77A-1f8wA:
undetectable		 4g77A-1f8wA:
21.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		5 ILE A 129
LEU A 133
ALA A 248
TYR A 323
ALA A 326
 None
 0.52A 4g77A-1h76A:
50.9		 4g77A-1h76A:
32.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		5 ILE A 468
LEU A 472
ALA A 589
TYR A 663
ALA A 666
 None
 0.61A 4g77A-1h76A:
50.9		 4g77A-1h76A:
32.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		5 ILE A 468
LEU A 472
HIS A 587
ALA A 589
TYR A 663
 None
 0.45A 4g77A-1h76A:
50.9		 4g77A-1h76A:
32.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1i6q LACTOFERRIN

(Camelus
dromedarius) 		PF00405
(Transferrin) 		4 ILE A 127
LEU A 131
HIS A 246
ALA A 248
 None
 0.58A 4g77A-1i6qA:
25.8		 4g77A-1i6qA:
42.98
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.
1iay 1-AMINOCYCLOPROPANE-
1-CARBOXYLATE
SYNTHASE 2

(Solanum
lycopersicum) 		PF00155
(Aminotran_1_2) 		4 ILE A 253
LEU A 257
HIS A 271
VAL A 235
 None
 0.76A 4g77A-1iayA:
undetectable		 4g77A-1iayA:
19.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		6 ILE A 130
LEU A 134
HIS A 242
ALA A 244
TYR A 319
ALA A 322
 None
 0.53A 4g77A-1jnfA:
50.5		 4g77A-1jnfA:
31.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		6 ILE A 461
LEU A 465
HIS A 575
ALA A 577
TYR A 652
ALA A 655
 None
 0.56A 4g77A-1jnfA:
50.5		 4g77A-1jnfA:
31.33
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.
1lbu MURAMOYL-PENTAPEPTID
E CARBOXYPEPTIDASE

(Streptomyces
albus) 		PF01471
(PG_binding_1)
PF08291
(Peptidase_M15_3) 		4 ILE A 184
HIS A 179
ALA A 176
ALA A 208
 None
 0.77A 4g77A-1lbuA:
undetectable		 4g77A-1lbuA:
22.35
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.
1mkm ICLR TRANSCRIPTIONAL
REGULATOR

(Thermotoga
maritima) 		PF01614
(IclR)
PF09339
(HTH_IclR) 		4 ILE A 201
LEU A 244
ALA A 210
ALA A  81
 None
 0.79A 4g77A-1mkmA:
undetectable		 4g77A-1mkmA:
22.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1n76 LACTOFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		4 HIS A 246
ALA A 248
TYR A 324
ALA A 327
 None
 0.39A 4g77A-1n76A:
53.1		 4g77A-1n76A:
41.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1n76 LACTOFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		5 ILE A 471
LEU A 475
HIS A 590
ALA A 592
TYR A 667
 None
 0.67A 4g77A-1n76A:
53.1		 4g77A-1n76A:
41.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nbw GLYCEROL DEHYDRATASE
REACTIVASE ALPHA
SUBUNIT

(Klebsiella
pneumoniae) 		PF08841
(DDR) 		4 ILE A 286
LEU A 266
ALA A 336
VAL A 337
 None
 0.66A 4g77A-1nbwA:
undetectable		 4g77A-1nbwA:
20.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nnt OVOTRANSFERRIN

(Gallus gallus) 		PF00405
(Transferrin) 		4 ILE A 127
ALA A 245
TYR A 324
ALA A 327
 None
 0.53A 4g77A-1nntA:
41.0		 4g77A-1nntA:
39.07
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.
1o9g RRNA
METHYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF11599
(AviRa) 		4 ILE A  39
LEU A  35
ALA A 237
VAL A 238
 None
 0.59A 4g77A-1o9gA:
undetectable		 4g77A-1o9gA:
22.22
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.
1q77 HYPOTHETICAL PROTEIN
AQ_178

(Aquifex
aeolicus) 		PF00582
(Usp) 		4 ILE A  67
LEU A  71
ALA A  36
VAL A  37
 None
 0.77A 4g77A-1q77A:
undetectable		 4g77A-1q77A:
16.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qjm LACTOFERRIN

(Equus caballus) 		PF00405
(Transferrin) 		5 ILE A 127
HIS A 246
ALA A 248
TYR A 324
ALA A 327
 None
 0.35A 4g77A-1qjmA:
53.7		 4g77A-1qjmA:
40.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qjm LACTOFERRIN

(Equus caballus) 		PF00405
(Transferrin) 		5 ILE A 469
LEU A 473
HIS A 588
ALA A 590
TYR A 665
 None
 0.56A 4g77A-1qjmA:
53.7		 4g77A-1qjmA:
40.68
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.
1ry2 ACETYL-COENZYME A
SYNTHETASE 1

(Saccharomyces
cerevisiae) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		4 ILE A 232
LEU A 228
ALA A 193
VAL A 192
 None
 0.55A 4g77A-1ry2A:
undetectable		 4g77A-1ry2A:
19.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ryo SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		6 ILE A 130
LEU A 134
HIS A 242
ALA A 244
TYR A 319
ALA A 322
 None
 0.58A 4g77A-1ryoA:
41.8		 4g77A-1ryoA:
42.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1suv SEROTRANSFERRIN,
C-LOBE

(Homo sapiens) 		PF00405
(Transferrin) 		6 ILE E 461
LEU E 465
HIS E 575
ALA E 577
TYR E 652
ALA E 655
 None
 0.55A 4g77A-1suvE:
50.3		 4g77A-1suvE:
58.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t2w SORTASE

(Staphylococcus
aureus) 		PF04203
(Sortase) 		4 ILE A  65
LEU A 110
ALA A  73
VAL A  72
 None
 0.73A 4g77A-1t2wA:
undetectable		 4g77A-1t2wA:
17.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tf1 NEGATIVE REGULATOR
OF ALLANTOIN AND
GLYOXYLATE
UTILIZATION OPERONS

(Escherichia
coli) 		PF01614
(IclR) 		4 ILE A 137
LEU A 180
ALA A 146
ALA A  17
 None
 0.77A 4g77A-1tf1A:
undetectable		 4g77A-1tf1A:
18.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tfd TRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		4 ILE A 130
LEU A 134
HIS A 242
ALA A 244
 None
 0.47A 4g77A-1tfdA:
34.6		 4g77A-1tfdA:
38.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tjy SUGAR TRANSPORT
PROTEIN

(Salmonella
enterica) 		PF13407
(Peripla_BP_4) 		4 ILE A 207
ALA A 156
VAL A 155
ALA A 228
 None
 0.76A 4g77A-1tjyA:
2.4		 4g77A-1tjyA:
21.87
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.
1ufv PANTOATE-BETA-ALANIN
E LIGASE

(Thermus
thermophilus) 		PF02569
(Pantoate_ligase) 		4 LEU A  28
ALA A  48
VAL A  47
ALA A  80
 None
 0.74A 4g77A-1ufvA:
undetectable		 4g77A-1ufvA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wz8 ENOYL-COA HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		4 LEU A 124
ALA A 115
VAL A 114
ALA A 180
 None
 0.82A 4g77A-1wz8A:
undetectable		 4g77A-1wz8A:
23.55
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.
1zjy R-SPECIFIC ALCOHOL
DEHYDROGENASE

(Lactobacillus
brevis) 		PF13561
(adh_short_C2) 		4 ILE A 225
LEU A 229
HIS A 186
VAL A 243
 None
 0.73A 4g77A-1zjyA:
undetectable		 4g77A-1zjyA:
18.63
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.
2b9u HYPOTHETICAL
DTDP-4-DEHYDRORHAMNO
SE 3,5-EPIMERASE

(Sulfurisphaera
tokodaii) 		PF00908
(dTDP_sugar_isom) 		4 ILE A 112
LEU A 110
ALA A  84
VAL A  85
 None
 0.82A 4g77A-2b9uA:
undetectable		 4g77A-2b9uA:
18.26
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.
2btm PROTEIN
(TRIOSEPHOSPHATE
ISOMERASE)

(Geobacillus
stearothermophilus) 		PF00121
(TIM) 		4 LEU A 153
ALA A 161
VAL A 162
ALA A 149
 None
 0.80A 4g77A-2btmA:
undetectable		 4g77A-2btmA:
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.
2c7l PHYCOERYTHROCYANIN
ALPHA CHAIN

(Mastigocladus
laminosus) 		PF00502
(Phycobilisome) 		4 ILE A  88
HIS A  58
ALA A 132
TYR A 129
 None
None
None
BLA  A1163 (-3.9A)
 0.76A 4g77A-2c7lA:
undetectable		 4g77A-2c7lA:
19.35
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.
2c7l PHYCOERYTHROCYANIN
ALPHA CHAIN

(Mastigocladus
laminosus) 		PF00502
(Phycobilisome) 		4 ILE A  88
LEU A  92
ALA A 132
TYR A 129
 None
None
None
BLA  A1163 (-3.9A)
 0.79A 4g77A-2c7lA:
undetectable		 4g77A-2c7lA:
19.35
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.
2d0o DIOL
DEHYDRATASE-REACTIVA
TING FACTOR LARGE
SUBUNIT

(Klebsiella
oxytoca) 		PF08841
(DDR) 		4 ILE A 284
LEU A 264
ALA A 334
VAL A 335
 None
 0.67A 4g77A-2d0oA:
undetectable		 4g77A-2d0oA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d3i OVOTRANSFERRIN

(Gallus gallus) 		PF00405
(Transferrin) 		4 ILE A 127
ALA A 245
TYR A 324
ALA A 327
 None
 0.43A 4g77A-2d3iA:
51.0		 4g77A-2d3iA:
28.59
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.
2gvi CONSERVED
HYPOTHETICAL PROTEIN

(Thermoplasma
acidophilum) 		PF02663
(FmdE) 		4 ILE A 136
LEU A 140
HIS A  18
ALA A 115
 None
None
ZN  A 300 (-3.1A)
None
 0.77A 4g77A-2gviA:
undetectable		 4g77A-2gviA:
21.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2hau SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		4 ILE A 130
LEU A 134
HIS A 242
ALA A 244
 None
 0.63A 4g77A-2hauA:
25.5		 4g77A-2hauA:
32.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hi1 4-HYDROXYTHREONINE-4
-PHOSPHATE
DEHYDROGENASE 2

(Salmonella
enterica) 		PF04166
(PdxA) 		4 ILE A   8
LEU A  35
ALA A 120
ALA A  24
 None
 0.82A 4g77A-2hi1A:
2.1		 4g77A-2hi1A:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2okx RHAMNOSIDASE B

(Bacillus sp.
GL1) 		PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		4 ILE A 784
VAL A 769
TYR A 748
ALA A 747
 None
 0.75A 4g77A-2okxA:
undetectable		 4g77A-2okxA:
16.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pl5 HOMOSERINE
O-ACETYLTRANSFERASE

(Leptospira
interrogans) 		PF00561
(Abhydrolase_1) 		5 LEU A 348
HIS A  53
ALA A  54
TYR A 314
ALA A 177
 None
 1.36A 4g77A-2pl5A:
undetectable		 4g77A-2pl5A:
23.22
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.
2veo LIPASE A

(Moesziomyces
antarcticus) 		PF03583
(LIP) 		4 ILE A 381
ALA A 179
VAL A 178
TYR A 135
 None
 0.79A 4g77A-2veoA:
undetectable		 4g77A-2veoA:
21.88
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.
2wu5 SUCCINATE
DEHYDROGENASE
FLAVOPROTEIN SUBUNIT

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 ILE A  26
ALA A  10
VAL A  11
ALA A 415
 None
 0.61A 4g77A-2wu5A:
undetectable		 4g77A-2wu5A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x0f WSAF

(Geobacillus
stearothermophilus) 		no annotation 4 ILE A  44
ALA A 131
VAL A 130
ALA A  81
 None
 0.72A 4g77A-2x0fA:
undetectable		 4g77A-2x0fA:
20.55
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.
2x1c ACYL-COENZYME

(Penicillium
chrysogenum) 		PF03417
(AAT) 		4 ILE A 131
LEU A 133
ALA A 149
ALA A  20
 None
 0.77A 4g77A-2x1cA:
undetectable		 4g77A-2x1cA:
20.70
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.
2xyq PUTATIVE 2'-O-METHYL
TRANSFERASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF06460
(NSP13) 		4 ILE A 128
LEU A 126
ALA A 168
TYR A  47
 None
None
None
SAH  A1293 (-4.8A)
 0.75A 4g77A-2xyqA:
undetectable		 4g77A-2xyqA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ys6 PHOSPHORIBOSYLGLYCIN
AMIDE SYNTHETASE

(Geobacillus
kaustophilus) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		4 ILE A  15
LEU A 304
VAL A  68
ALA A 293
 None
 0.69A 4g77A-2ys6A:
undetectable		 4g77A-2ys6A:
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.
2z6i TRANS-2-ENOYL-ACP
REDUCTASE II

(Streptococcus
pneumoniae) 		PF03060
(NMO) 		5 ILE A   5
LEU A   9
ALA A 187
VAL A 188
ALA A 133
 None
 1.27A 4g77A-2z6iA:
undetectable		 4g77A-2z6iA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3blw ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF00180
(Iso_dh) 		4 ILE A 198
ALA A 180
VAL A 181
ALA A 166
 None
 0.79A 4g77A-3blwA:
undetectable		 4g77A-3blwA:
22.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d0q PROTEIN CALG3

(Micromonospora
echinospora) 		PF06722
(DUF1205) 		4 LEU A 271
ALA A 214
VAL A 213
ALA A 296
 None
 0.70A 4g77A-3d0qA:
undetectable		 4g77A-3d0qA:
21.48
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.
3ejw SMLSRB

(Sinorhizobium
meliloti) 		PF13407
(Peripla_BP_4) 		4 ILE A 181
ALA A 130
VAL A 129
ALA A 202
 None
 0.71A 4g77A-3ejwA:
2.3		 4g77A-3ejwA:
20.87
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.
3f6a HYDROLASE, NUDIX
FAMILY

(Clostridium
perfringens) 		PF00293
(NUDIX) 		4 ILE A 134
LEU A 139
HIS A 132
ALA A 131
 None
 0.81A 4g77A-3f6aA:
undetectable		 4g77A-3f6aA:
17.24
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.
3gaa UNCHARACTERIZED
PROTEIN TA1441

(Thermoplasma
acidophilum) 		PF09754
(PAC2) 		4 ILE A 156
ALA A 141
VAL A 142
ALA A 209
 None
 0.82A 4g77A-3gaaA:
undetectable		 4g77A-3gaaA:
21.74
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.
3hvd PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		4 ILE A 635
LEU A 639
ALA A 615
ALA A 607
 None
 0.65A 4g77A-3hvdA:
undetectable		 4g77A-3hvdA:
21.28
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.
3jyo QUINATE/SHIKIMATE
DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF08501
(Shikimate_dh_N) 		4 ILE A 188
ALA A 157
VAL A 156
ALA A 213
 None
None
None
NAD  A 377 ( 4.0A)
 0.79A 4g77A-3jyoA:
undetectable		 4g77A-3jyoA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kv6 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1D

(Homo sapiens) 		PF00628
(PHD)
PF02373
(JmjC) 		4 HIS A 354
ALA A 355
VAL A 356
ALA A 117
 FE2  A 491 (-3.4A)
None
AKG  A 702 (-4.0A)
None
 0.61A 4g77A-3kv6A:
undetectable		 4g77A-3kv6A:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l2n PEPTIDASE M14,
CARBOXYPEPTIDASE A

(Shewanella
denitrificans) 		PF00246
(Peptidase_M14) 		4 ILE A  95
LEU A  93
ALA A  72
VAL A  73
 None
 0.74A 4g77A-3l2nA:
undetectable		 4g77A-3l2nA:
22.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mc2 INHIBITOR OF
CARBONIC ANHYDRASE

(Mus musculus) 		PF00405
(Transferrin) 		4 LEU A 467
HIS A 581
ALA A 583
TYR A 657
 None
 0.52A 4g77A-3mc2A:
38.6		 4g77A-3mc2A:
34.28
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.
3ntd FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Shewanella
loihica) 		PF00581
(Rhodanese)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 ILE A 285
LEU A 277
ALA A 300
VAL A 301
 None
 0.67A 4g77A-3ntdA:
undetectable		 4g77A-3ntdA:
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.
3r13 DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Thermotoga
maritima) 		PF01791
(DeoC) 		4 ILE A  49
LEU A  52
VAL A  71
ALA A  44
 None
 0.82A 4g77A-3r13A:
undetectable		 4g77A-3r13A:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r24 2'-O-METHYL
TRANSFERASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF06460
(NSP13) 		4 ILE A 128
LEU A 126
ALA A 168
TYR A  47
 None
None
None
SAM  A 302 (-4.5A)
 0.73A 4g77A-3r24A:
undetectable		 4g77A-3r24A:
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.
3slr UNCHARACTERIZED
PROTEIN BF1531

(Bacteroides
fragilis) 		no annotation 4 ILE A 320
LEU A 324
ALA A 276
VAL A 277
 None
 0.82A 4g77A-3slrA:
undetectable		 4g77A-3slrA:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tcv GCN5-RELATED
N-ACETYLTRANSFERASE

(Brucella
abortus) 		PF13302
(Acetyltransf_3) 		4 ILE A 117
ALA A  91
VAL A  90
ALA A 126
 None
 0.82A 4g77A-3tcvA:
undetectable		 4g77A-3tcvA:
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.
3u78 LYSINE-SPECIFIC
DEMETHYLASE 7

(Homo sapiens) 		PF02373
(JmjC) 		4 HIS A 354
ALA A 355
VAL A 356
ALA A 117
 NI  A 702 ( 3.5A)
None
AKG  A 701 (-4.1A)
None
 0.70A 4g77A-3u78A:
undetectable		 4g77A-3u78A:
23.33
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.
3vvd AMINO ACID ABC
TRANSPORTER, BINDING
PROTEIN

(Thermus
thermophilus) 		PF00497
(SBP_bac_3) 		4 HIS A  95
ALA A 194
VAL A 193
ALA A  86
 None
 0.72A 4g77A-3vvdA:
7.4		 4g77A-3vvdA:
20.67
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.
4a45 ALPHA-N-ACETYLGLUCOS
AMINIDASE FAMILY
PROTEIN

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C) 		4 ILE A1431
ALA A1476
VAL A1475
ALA A1486
 None
 0.76A 4g77A-4a45A:
undetectable		 4g77A-4a45A:
18.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bma UDP-N-ACETYLGLUCOSAM
INE
PYROPHOSPHORYLASE

(Aspergillus
fumigatus) 		PF01704
(UDPGP) 		4 ILE A 186
HIS A 274
ALA A 286
ALA A 176
 None
 0.82A 4g77A-4bmaA:
undetectable		 4g77A-4bmaA:
22.00
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.
4e6e CELL DIVISION
PROTEIN FTSZ

(Thermobifida
fusca) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		4 ILE A 272
ALA A 293
VAL A 294
ALA A 234
 None
 0.81A 4g77A-4e6eA:
undetectable		 4g77A-4e6eA:
22.83
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.
4fgs PROBABLE
DEHYDROGENASE
PROTEIN

(Rhizobium etli) 		PF13561
(adh_short_C2) 		4 ILE A  51
ALA A  55
VAL A  56
ALA A  15
 None
 0.82A 4g77A-4fgsA:
undetectable		 4g77A-4fgsA:
20.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4fim LACTOTRANSFERRIN

(Bos taurus) 		PF00405
(Transferrin) 		7 ILE A 469
LEU A 473
HIS A 588
ALA A 590
VAL A 591
TYR A 665
ALA A 668
 None
NAG  A 707 ( 4.7A)
ZN  A 704 (-3.2A)
None
None
CEL  A 711 (-4.5A)
NAG  A 707 ( 3.8A)
 0.08A 4g77A-4fimA:
60.9		 4g77A-4fimA:
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.
4kma GM14141P

(Drosophila
melanogaster) 		PF05076
(SUFU)
PF12470
(SUFU_C) 		4 ILE A 450
LEU A 448
ALA A 355
ALA A 425
 None
 0.82A 4g77A-4kmaA:
undetectable		 4g77A-4kmaA:
22.55
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.
4n7t PHOSPHOPENTOMUTASE

(Streptococcus
mutans) 		PF01676
(Metalloenzyme) 		4 ILE A 259
LEU A 234
ALA A 246
VAL A 247
 None
 0.82A 4g77A-4n7tA:
undetectable		 4g77A-4n7tA:
21.48
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.
4ntc GLIT

(Aspergillus
fumigatus) 		PF07992
(Pyr_redox_2) 		4 ILE A 275
LEU A 267
ALA A 291
VAL A 292
 None
 0.60A 4g77A-4ntcA:
undetectable		 4g77A-4ntcA:
22.64
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.
4qb9 ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN

(Mycolicibacterium
smegmatis) 		PF13527
(Acetyltransf_9)
PF13530
(SCP2_2) 		4 ILE A 108
LEU A 104
ALA A  80
VAL A  79
 None
 0.73A 4g77A-4qb9A:
undetectable		 4g77A-4qb9A:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qrj PUTATIVE
6-PHOSPHOGLUCONOLACT
ONASE

(Bacteroides
uniformis) 		PF10282
(Lactonase) 		4 ILE A 358
LEU A 330
ALA A  57
VAL A  58
 None
 0.75A 4g77A-4qrjA:
undetectable		 4g77A-4qrjA:
21.30
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.
4rf3 NADPH DEPENDENT
R-SPECIFIC ALCOHOL
DEHYDROGENASE

(Lactobacillus
kefiri) 		PF13561
(adh_short_C2) 		4 ILE A 226
LEU A 230
HIS A 187
VAL A 244
 None
 0.70A 4g77A-4rf3A:
undetectable		 4g77A-4rf3A:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tr4 TYPE III
IODOTHYRONINE
DEIODINASE

(Mus musculus) 		PF00837
(T4_deiodinase) 		4 ILE A 264
LEU A 163
ALA A 135
ALA A 155
 None
 0.77A 4g77A-4tr4A:
undetectable		 4g77A-4tr4A:
19.73
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.
5az4 FLAGELLAR HOOK
SUBUNIT PROTEIN

(Campylobacter
jejuni) 		PF07196
(Flagellin_IN)
PF07559
(FlaE) 		4 ILE A 320
LEU A 300
ALA A 337
VAL A 338
 None
 0.58A 4g77A-5az4A:
undetectable		 4g77A-5az4A:
17.68
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.
5djw ALPHA-GLUCOSIDASE II

(Bacteroides
thetaiotaomicron) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF17137
(DUF5110) 		4 ILE A 447
ALA A 483
TYR A 178
ALA A 456
 None
 0.81A 4g77A-5djwA:
undetectable		 4g77A-5djwA:
20.59
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.
5f05 PHI CLASS
GLUTATHIONE
TRANSFERASE GSTF5

(Populus
trichocarpa) 		PF00043
(GST_C)
PF02798
(GST_N) 		4 ILE A  71
HIS A   7
ALA A  58
VAL A  59
 None
 0.79A 4g77A-5f05A:
undetectable		 4g77A-5f05A:
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.
5fsr D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACD

(Escherichia
coli) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		4 ILE A  28
ALA A  31
TYR A 161
ALA A 164
 None
 0.69A 4g77A-5fsrA:
undetectable		 4g77A-5fsrA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h28 OXYSTEROL-BINDING
PROTEIN HOMOLOG 1

(Saccharomyces
cerevisiae) 		PF13637
(Ank_4) 		4 ILE A  68
LEU A  56
HIS A  73
ALA A 104
 None
 0.79A 4g77A-5h28A:
undetectable		 4g77A-5h28A:
20.85
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.
5hba UNCHARACTERIZED
PROTEIN

(Danio rerio) 		PF00386
(C1q) 		4 ILE A 106
LEU A  66
HIS A  55
VAL A 125
 None
 0.81A 4g77A-5hbaA:
undetectable		 4g77A-5hbaA:
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.
5jzd ISOCHORISMATE
SYNTHASE ENTC

(Escherichia
coli) 		PF00425
(Chorismate_bind) 		4 ILE A  78
ALA A  43
VAL A  44
ALA A 295
 None
 0.82A 4g77A-5jzdA:
undetectable		 4g77A-5jzdA:
21.93
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.
5mjk THIOREDOXIN
REDUCTASE

(Lactococcus
lactis) 		PF07992
(Pyr_redox_2) 		4 ILE A 259
ALA A 274
VAL A 275
ALA A 244
 None
 0.70A 4g77A-5mjkA:
undetectable		 4g77A-5mjkA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mqi PROTEIN TIMELESS
HOMOLOG,PROTEIN
TIMELESS HOMOLOG

(Homo sapiens) 		PF04821
(TIMELESS) 		4 ILE A 411
LEU A 415
ALA A 442
TYR A 378
 None
 0.69A 4g77A-5mqiA:
undetectable		 4g77A-5mqiA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ngd PORTAL PROTEIN

(Thermus virus
P74-26) 		no annotation 4 ALA A 351
VAL A 352
TYR A 125
ALA A 128
 None
 0.71A 4g77A-5ngdA:
undetectable		 4g77A-5ngdA:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ou3 INOSINE-5'-MONOPHOSP
HATE
DEHYDROGENASE,INOSIN
E-5'-MONOPHOSPHATE
DEHYDROGENASE

(Mycolicibacterium
thermoresistibile) 		no annotation 4 LEU A 153
HIS A 146
ALA A 147
ALA A 188
 None
AUN  A 401 (-4.4A)
None
None
 0.82A 4g77A-5ou3A:
undetectable		 4g77A-5ou3A:
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.
5ty7 PENICILLIN-BINDING
PROTEIN 4

(Staphylococcus
aureus) 		no annotation 4 ILE A 320
LEU A 321
HIS A 362
ALA A 363
 None
None
ZN  A 403 ( 4.8A)
None
 0.69A 4g77A-5ty7A:
undetectable		 4g77A-5ty7A:
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.
5v1b EGL NINE HOMOLOG 2

(Homo sapiens) 		PF13640
(2OG-FeII_Oxy_3) 		4 ILE A 191
LEU A 348
ALA A 338
VAL A 337
 None
 0.81A 4g77A-5v1bA:
undetectable		 4g77A-5v1bA:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wyg PROBABLE
ENDORIBONUCLEASE
MAZF7

(Mycobacterium
tuberculosis) 		PF02452
(PemK_toxin) 		4 ILE A 103
LEU A  95
ALA A  75
VAL A  76
 None
 0.70A 4g77A-5wygA:
undetectable		 4g77A-5wygA:
17.99
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.
5xzd ENOYL-COA HYDRATASE

(Roseovarius
nubinhibens) 		no annotation 4 ILE A 120
LEU A 176
ALA A 114
ALA A 126
 None
 0.65A 4g77A-5xzdA:
undetectable		 4g77A-5xzdA:
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.
6blg DTDP-4-AMINO-4,6-DID
EOXYGALACTOSE
TRANSAMINASE

(Klebsiella
pneumoniae) 		no annotation 4 ILE A  68
ALA A  93
VAL A  89
ALA A 122
 None
 0.75A 4g77A-6blgA:
undetectable		 4g77A-6blgA:
21.67
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.
6cty DIHYDROOROTASE

(Yersinia pestis) 		no annotation 4 ILE A  18
LEU A  20
ALA A  40
ALA A 272
 None
 0.78A 4g77A-6ctyA:
undetectable		 4g77A-6ctyA:
undetectable