SIMILAR PATTERNS OF AMINO ACIDS FOR 6PAH_A_DAHA600

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.
1bf6 PHOSPHOTRIESTERASE
HOMOLOGY PROTEIN

(Escherichia
coli) 		PF02126
(PTE) 		4 HIS A  12
HIS A  14
TYR A  84
GLU A 125
 ZN  A   1 (-3.5A)
ZN  A   1 (-3.4A)
None
ZN  A 293 ( 2.5A)
 1.08A 6pahA-1bf6A:
undetectable		 6pahA-1bf6A:
20.92
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.
1bqb PROTEIN (AUREOLYSIN)

(Staphylococcus
aureus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 HIS A 144
HIS A 148
TYR A 159
GLU A 168
 ZN  A 350 (-3.3A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-2.2A)
 0.90A 6pahA-1bqbA:
undetectable		 6pahA-1bqbA:
21.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1dmw PHENYLALANINE
HYDROXYLASE

(Homo sapiens) 		PF00351
(Biopterin_H) 		6 LEU A 248
PRO A 281
HIS A 285
HIS A 290
TYR A 325
GLU A 330
 HBI  A 700 ( 4.5A)
None
FE  A 425 (-3.4A)
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
FE  A 425 (-2.5A)
 0.51A 6pahA-1dmwA:
53.1		 6pahA-1dmwA:
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.
1dpp DIPEPTIDE BINDING
PROTEIN

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		4 LEU A 229
HIS A 499
TYR A 491
GLU A 482
 None
 0.94A 6pahA-1dppA:
undetectable		 6pahA-1dppA:
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.
1fw8 PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		4 LEU A 372
PRO A   7
TYR A  51
GLU A  47
 None
 0.94A 6pahA-1fw8A:
undetectable		 6pahA-1fw8A:
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.
1j5w GLYCYL-TRNA
SYNTHETASE ALPHA
CHAIN

(Thermotoga
maritima) 		PF02091
(tRNA-synt_2e) 		4 LEU A 230
PRO A  36
HIS A  35
GLU A  22
 None
 1.02A 6pahA-1j5wA:
undetectable		 6pahA-1j5wA:
23.88
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.
1ltz PHENYLALANINE-4-HYDR
OXYLASE

(Chromobacterium
violaceum) 		PF00351
(Biopterin_H) 		4 LEU A 101
HIS A 138
HIS A 143
TYR A 179
 HBI  A 500 ( 4.5A)
FE  A 400 (-3.3A)
FE  A 400 (-3.4A)
HBI  A 500 ( 4.0A)
 0.80A 6pahA-1ltzA:
27.9		 6pahA-1ltzA:
28.31
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.
1ltz PHENYLALANINE-4-HYDR
OXYLASE

(Chromobacterium
violaceum) 		PF00351
(Biopterin_H) 		5 PRO A 134
HIS A 138
HIS A 143
TYR A 179
GLU A 184
 None
FE  A 400 (-3.3A)
FE  A 400 (-3.4A)
HBI  A 500 ( 4.0A)
FE  A 400 (-1.9A)
 0.51A 6pahA-1ltzA:
27.9		 6pahA-1ltzA:
28.31
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.
1mpy CATECHOL
2,3-DIOXYGENASE

(Pseudomonas
putida) 		PF00903
(Glyoxalase) 		4 LEU A 212
HIS A 153
TYR A 255
GLU A 265
 None
FE2  A 308 (-3.6A)
None
FE2  A 308 (-2.6A)
 0.66A 6pahA-1mpyA:
undetectable		 6pahA-1mpyA:
23.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n0s BILIN-BINDING
PROTEIN

(Pieris
brassicae) 		PF00061
(Lipocalin) 		4 PRO A   9
HIS A 124
HIS A   4
TYR A  32
 None
 1.05A 6pahA-1n0sA:
undetectable		 6pahA-1n0sA:
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.
1npc NEUTRAL PROTEASE

(Bacillus cereus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 HIS A 143
HIS A 147
TYR A 158
GLU A 167
 ZN  A 323 ( 3.3A)
ZN  A 323 ( 3.2A)
None
ZN  A 323 ( 2.0A)
 0.82A 6pahA-1npcA:
undetectable		 6pahA-1npcA:
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.
1o4t PUTATIVE OXALATE
DECARBOXYLASE

(Thermotoga
maritima) 		PF07883
(Cupin_2) 		4 LEU A  52
HIS A  61
HIS A 102
GLU A  68
 None
MN  A 300 ( 3.3A)
MN  A 300 ( 3.4A)
MN  A 300 ( 2.7A)
 1.10A 6pahA-1o4tA:
undetectable		 6pahA-1o4tA:
19.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1phz PROTEIN
(PHENYLALANINE
HYDROXYLASE)

(Rattus
norvegicus) 		PF00351
(Biopterin_H)
PF01842
(ACT) 		6 LEU A 248
PRO A 281
HIS A 285
HIS A 290
TYR A 325
GLU A 330
 None
None
FE  A 501 ( 3.6A)
FE  A 501 ( 3.7A)
None
FE  A 501 ( 2.8A)
 0.83A 6pahA-1phzA:
47.1		 6pahA-1phzA:
95.45
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.
1rxq YFIT

(Bacillus
subtilis) 		PF12867
(DinB_2) 		4 LEU A 156
HIS A  67
TYR A  93
GLU A  95
 None
NI  A 300 (-3.3A)
None
NI  A 300 ( 4.1A)
 0.92A 6pahA-1rxqA:
undetectable		 6pahA-1rxqA:
20.13
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.
1sp8 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Zea mays) 		PF00903
(Glyoxalase) 		4 LEU A  97
HIS A 219
HIS A 301
GLU A 387
 None
FE2  A 500 (-3.3A)
FE2  A 500 (-3.4A)
FE2  A 500 (-2.7A)
 1.04A 6pahA-1sp8A:
undetectable		 6pahA-1sp8A:
18.68
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.
1ujn DEHYDROQUINATE
SYNTHASE

(Thermus
thermophilus) 		PF01761
(DHQ_synthase) 		4 LEU A 277
HIS A 247
HIS A 231
GLU A 173
 None
 1.07A 6pahA-1ujnA:
undetectable		 6pahA-1ujnA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ujn DEHYDROQUINATE
SYNTHASE

(Thermus
thermophilus) 		PF01761
(DHQ_synthase) 		4 LEU A 281
HIS A 247
HIS A 231
GLU A 173
 None
 0.86A 6pahA-1ujnA:
undetectable		 6pahA-1ujnA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y79 PEPTIDYL-DIPEPTIDASE
DCP

(Escherichia
coli) 		PF01432
(Peptidase_M3) 		4 LEU 1 550
HIS 1 469
TYR 1 607
GLU 1 498
 ASP  1 704 ( 4.7A)
ZN  1 700 (-3.2A)
LYS  1 701 (-4.1A)
ZN  1 700 ( 2.2A)
 1.06A 6pahA-1y791:
undetectable		 6pahA-1y791:
18.17
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.
1z1w TRICORN PROTEASE
INTERACTING FACTOR
F3

(Thermoplasma
acidophilum) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 LEU A 358
HIS A 269
HIS A 265
GLU A 288
 None
ZN  A 800 (-3.2A)
ZN  A 800 (-3.3A)
ZN  A 800 (-2.8A)
 0.95A 6pahA-1z1wA:
undetectable		 6pahA-1z1wA:
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.
2dqb DEOXYGUANOSINETRIPHO
SPHATE
TRIPHOSPHOHYDROLASE,
PUTATIVE

(Thermus
thermophilus) 		PF01966
(HD)
PF13286
(HD_assoc) 		4 LEU A  58
HIS A 135
HIS A 117
TYR A 200
 None
None
None
MG  A 506 (-4.3A)
 0.91A 6pahA-2dqbA:
undetectable		 6pahA-2dqbA:
21.46
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.
2hk0 D-PSICOSE
3-EPIMERASE

(Agrobacterium
tumefaciens) 		PF01261
(AP_endonuc_2) 		4 LEU A 108
HIS A 207
HIS A 209
GLU A  34
 LEU  A 108 ( 0.6A)
HIS  A 207 ( 1.0A)
HIS  A 209 ( 1.0A)
GLU  A  34 ( 0.6A)
 0.90A 6pahA-2hk0A:
undetectable		 6pahA-2hk0A:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j66 BTRK

(Bacillus
circulans) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		4 LEU A 286
PRO A 344
HIS A 304
HIS A 305
 None
 1.08A 6pahA-2j66A:
undetectable		 6pahA-2j66A:
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.
2o3e NEUROLYSIN

(Rattus
norvegicus) 		PF01432
(Peptidase_M3) 		5 PRO A 505
HIS A 478
HIS A 474
TYR A 613
GLU A 503
 None
ZN  A 679 (-3.3A)
ZN  A 679 (-3.4A)
None
ZN  A 679 (-2.1A)
 1.27A 6pahA-2o3eA:
undetectable		 6pahA-2o3eA:
20.35
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.
2oej 2,3-DIKETO-5-METHYLT
HIOPENTYL-1-PHOSPHAT
E ENOLASE

(Geobacillus
kaustophilus) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		4 LEU A 178
HIS A 363
TYR A 156
GLU A 160
 None
 1.05A 6pahA-2oejA:
undetectable		 6pahA-2oejA:
20.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2toh TYROSINE
3-MONOOXYGENASE

(Rattus
norvegicus) 		PF00351
(Biopterin_H) 		5 LEU A 294
PRO A 327
HIS A 331
HIS A 336
TYR A 371
 HBI  A 500 (-4.7A)
HBI  A 500 (-4.1A)
FE  A 501 ( 3.3A)
FE  A 501 ( 3.4A)
MTY  A 300 (-3.9A)
 0.74A 6pahA-2tohA:
47.8		 6pahA-2tohA:
62.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2toh TYROSINE
3-MONOOXYGENASE

(Rattus
norvegicus) 		PF00351
(Biopterin_H) 		5 PRO A 327
HIS A 331
HIS A 336
TYR A 371
GLU A 376
 HBI  A 500 (-4.1A)
FE  A 501 ( 3.3A)
FE  A 501 ( 3.4A)
MTY  A 300 (-3.9A)
FE  A 501 (-2.1A)
 0.47A 6pahA-2tohA:
47.8		 6pahA-2tohA:
62.22
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.
2v28 PHENYLALANINE-4-HYDR
OXYLASE

(Colwellia
psychrerythraea) 		PF00351
(Biopterin_H) 		5 PRO A 118
HIS A 122
HIS A 127
TYR A 162
GLU A 167
 None
 0.59A 6pahA-2v28A:
28.0		 6pahA-2v28A:
29.34
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.
2vqx METALLOPROTEINASE

(Serratia
proteamaculans) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C)
PF16485
(PLN_propep) 		4 HIS A 162
HIS A 166
TYR A 177
GLU A 186
 ZN  A1342 (-3.4A)
ZN  A1342 (-3.3A)
None
ZN  A1342 (-2.4A)
 0.82A 6pahA-2vqxA:
undetectable		 6pahA-2vqxA:
23.34
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.
2wyh ALPHA-MANNOSIDASE

(Streptococcus
pyogenes) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		4 LEU A  94
HIS A 363
TYR A 574
GLU A 573
 None
 1.08A 6pahA-2wyhA:
undetectable		 6pahA-2wyhA:
16.51
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.
2x66 PRNB

(Pseudomonas
fluorescens) 		PF08933
(DUF1864) 		4 LEU A 108
HIS A  15
TYR A 261
GLU A 152
 None
 1.07A 6pahA-2x66A:
undetectable		 6pahA-2x66A:
24.49
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.
2xpz LEUKOTRIENE A-4
HYDROLASE

(Saccharomyces
cerevisiae) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		4 LEU A 436
HIS A 344
HIS A 340
GLU A 363
 None
ZN  A1673 (-3.5A)
ZN  A1673 (-3.3A)
ZN  A1673 (-2.2A)
 0.96A 6pahA-2xpzA:
undetectable		 6pahA-2xpzA:
18.43
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.
2yb4 AMIDOHYDROLASE

(Chromobacterium
violaceum) 		PF02811
(PHP) 		4 LEU A  45
HIS A   9
HIS A   7
GLU A  64
 None
 0.98A 6pahA-2yb4A:
undetectable		 6pahA-2yb4A:
23.43
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.
2yd0 ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 1

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 LEU A 445
HIS A 357
HIS A 353
GLU A 376
 None
BES  A1950 ( 3.3A)
ZN  A1946 ( 3.3A)
ZN  A1946 ( 2.1A)
 1.01A 6pahA-2yd0A:
undetectable		 6pahA-2yd0A:
15.70
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.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		4 LEU A 390
HIS A 300
HIS A 299
TYR A 254
 HAS  A1015 ( 3.6A)
CU  A1017 ( 3.1A)
CU  A1017 ( 3.3A)
HAS  A1016 (-4.4A)
 0.98A 6pahA-2yevA:
undetectable		 6pahA-2yevA:
16.39
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.
2zws NEUTRAL CERAMIDASE

(Pseudomonas
aeruginosa) 		PF04734
(Ceramidase_alk)
PF17048
(Ceramidse_alk_C) 		4 HIS A 204
HIS A  97
TYR A 445
GLU A 411
 ZN  A 647 (-3.3A)
ZN  A 647 (-3.4A)
None
ZN  A 647 (-2.0A)
 0.94A 6pahA-2zwsA:
undetectable		 6pahA-2zwsA:
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.
3b9e CHITINASE A

(Vibrio harveyi) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		4 LEU A 567
HIS A 549
TYR A 153
GLU A 585
 None
 0.88A 6pahA-3b9eA:
undetectable		 6pahA-3b9eA:
19.93
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.
3cia COLD-ACTIVE
AMINOPEPTIDASE

(Colwellia
psychrerythraea) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		4 LEU A 417
HIS A 328
HIS A 324
GLU A 347
 None
ZN  A 701 (-3.8A)
ZN  A 701 (-4.1A)
ZN  A 701 (-3.4A)
 0.99A 6pahA-3ciaA:
undetectable		 6pahA-3ciaA:
18.72
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.
3csk PROBABLE
DIPEPTIDYL-PEPTIDASE
3

(Saccharomyces
cerevisiae) 		PF03571
(Peptidase_M49) 		4 LEU A 634
HIS A 465
HIS A 460
GLU A 517
 None
ZN  A 712 (-3.3A)
ZN  A 712 (-3.3A)
ZN  A 712 (-2.3A)
 0.83A 6pahA-3cskA:
undetectable		 6pahA-3cskA:
16.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cx3 LIPOPROTEIN

(Streptococcus
pneumoniae) 		PF01297
(ZnuA) 		4 PRO A 146
HIS A 147
HIS A 211
GLU A 286
 None
ZN  A 314 (-3.2A)
ZN  A 314 (-3.3A)
ZN  A 314 (-2.4A)
 1.04A 6pahA-3cx3A:
undetectable		 6pahA-3cx3A:
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.
3e38 TWO-DOMAIN PROTEIN
CONTAINING PREDICTED
PHP-LIKE
METAL-DEPENDENT
PHOSPHOESTERASE

(Bacteroides
vulgatus) 		PF16392
(DUF5001) 		4 LEU A 128
HIS A  46
HIS A  44
GLU A 113
 None
ZN  A   2 ( 3.2A)
ZN  A   2 (-3.4A)
ZN  A   2 (-2.7A)
 1.10A 6pahA-3e38A:
undetectable		 6pahA-3e38A:
21.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3hf8 TRYPTOPHAN
5-HYDROXYLASE 1

(Homo sapiens) 		PF00351
(Biopterin_H) 		5 PRO A 268
HIS A 272
HIS A 277
TYR A 312
GLU A 317
 ML0  A 401 (-3.6A)
FE  A 400 ( 3.3A)
FE  A 400 (-3.2A)
None
FE  A 400 ( 1.9A)
 0.65A 6pahA-3hf8A:
41.7		 6pahA-3hf8A:
66.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hq0 CATECHOL
2,3-DIOXYGENASE

(Pseudomonas
alkylphenolica) 		PF00903
(Glyoxalase) 		4 LEU A 214
HIS A 154
TYR A 257
GLU A 267
 None
FE  A 310 (-3.3A)
None
FE  A 310 (-2.8A)
 0.78A 6pahA-3hq0A:
undetectable		 6pahA-3hq0A:
25.91
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.
3k2g RESINIFERATOXIN-BIND
ING,
PHOSPHOTRIESTERASE-R
ELATED PROTEIN

(Rhodobacter
sphaeroides) 		PF02126
(PTE) 		4 HIS A  32
HIS A  34
TYR A 134
GLU A 175
 ZN  A 400 (-3.3A)
ZN  A 400 (-3.3A)
DTV  A 402 ( 4.4A)
ZN  A 401 ( 2.6A)
 1.09A 6pahA-3k2gA:
undetectable		 6pahA-3k2gA:
21.95
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.
3k2g RESINIFERATOXIN-BIND
ING,
PHOSPHOTRIESTERASE-R
ELATED PROTEIN

(Rhodobacter
sphaeroides) 		PF02126
(PTE) 		4 LEU A 204
HIS A  32
HIS A 236
GLU A 175
 None
ZN  A 400 (-3.3A)
ZN  A 401 (-3.5A)
ZN  A 401 ( 2.6A)
 1.09A 6pahA-3k2gA:
undetectable		 6pahA-3k2gA:
21.95
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.
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii) 		PF00903
(Glyoxalase) 		4 LEU A 215
HIS A 155
TYR A 258
GLU A 268
 None
FE  A 400 ( 3.5A)
None
FE  A 400 (-2.7A)
 0.87A 6pahA-3lm4A:
undetectable		 6pahA-3lm4A:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pic CIP2

(Trichoderma
reesei) 		no annotation 4 LEU A 422
PRO A 415
HIS A 409
GLU A 301
 None
 1.00A 6pahA-3picA:
undetectable		 6pahA-3picA:
19.90
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.
3qbd 3-DEHYDROQUINATE
SYNTHASE

(Mycobacterium
tuberculosis) 		PF01761
(DHQ_synthase) 		4 LEU A 303
HIS A 265
HIS A 249
GLU A 186
 None
 1.00A 6pahA-3qbdA:
undetectable		 6pahA-3qbdA:
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.
3qm3 FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Campylobacter
jejuni) 		PF01116
(F_bP_aldolase) 		4 LEU A 166
HIS A 105
HIS A 260
GLU A 169
 None
ZN  A 355 (-3.2A)
ZN  A 355 (-3.2A)
ZN  A 355 (-1.9A)
 1.00A 6pahA-3qm3A:
undetectable		 6pahA-3qm3A:
22.34
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.
3qm3 FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Campylobacter
jejuni) 		PF01116
(F_bP_aldolase) 		4 LEU A 236
HIS A 260
HIS A 221
GLU A 169
 None
ZN  A 355 (-3.2A)
ZN  A 355 (-3.2A)
ZN  A 355 (-1.9A)
 1.06A 6pahA-3qm3A:
undetectable		 6pahA-3qm3A:
22.34
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.
3r3j GLUTAMATE
DEHYDROGENASE

(Plasmodium
falciparum) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		4 LEU A 340
HIS A 457
TYR A 274
GLU A 270
 None
 1.07A 6pahA-3r3jA:
undetectable		 6pahA-3r3jA:
20.50
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.
3rhg PUTATIVE
PHOPHOTRIESTERASE

(Proteus
mirabilis) 		PF02126
(PTE) 		4 LEU A  30
HIS A 229
HIS A  23
GLU A 166
 UNL  A 374 ( 3.6A)
ZN  A 368 (-3.2A)
ZN  A 367 ( 3.2A)
ZN  A 368 (-2.5A)
 0.97A 6pahA-3rhgA:
undetectable		 6pahA-3rhgA:
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.
3rhg PUTATIVE
PHOPHOTRIESTERASE

(Proteus
mirabilis) 		PF02126
(PTE) 		4 LEU A 297
HIS A 229
HIS A  23
GLU A 166
 None
ZN  A 368 (-3.2A)
ZN  A 367 ( 3.2A)
ZN  A 368 (-2.5A)
 0.99A 6pahA-3rhgA:
undetectable		 6pahA-3rhgA:
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.
3sdp IRON SUPEROXIDE
DISMUTASE

(Pseudomonas
putida) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 LEU A 169
HIS A 160
HIS A  26
TYR A  77
 None
FE  A 196 ( 3.5A)
FE  A 196 ( 3.7A)
None
 0.94A 6pahA-3sdpA:
undetectable		 6pahA-3sdpA:
20.33
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.
3sks PUTATIVE
OLIGOENDOPEPTIDASE F

(Bacillus
anthracis) 		no annotation 4 LEU A 518
HIS A 360
HIS A 356
GLU A 384
 None
ZN  A 568 ( 3.3A)
ZN  A 568 ( 3.3A)
ZN  A 568 ( 2.0A)
 0.76A 6pahA-3sksA:
undetectable		 6pahA-3sksA:
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.
3tgn ADC OPERON REPRESSOR
ADCR

(Streptococcus
pneumoniae) 		PF01047
(MarR) 		4 LEU A  57
HIS A 108
HIS A 112
GLU A  24
 None
ZN  A 147 (-3.2A)
ZN  A 147 (-3.2A)
ZN  A 147 (-2.1A)
 1.05A 6pahA-3tgnA:
undetectable		 6pahA-3tgnA:
16.88
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.
3u9w LEUKOTRIENE A-4
HYDROLASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		4 LEU A1390
HIS A1299
HIS A1295
GLU A1318
 None
ZN  A2001 ( 3.2A)
ZN  A2001 ( 3.2A)
ZN  A2001 ( 2.2A)
 0.96A 6pahA-3u9wA:
undetectable		 6pahA-3u9wA:
19.02
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.
3zlb PHOSPHOGLYCERATE
KINASE

(Streptococcus
pneumoniae) 		PF00162
(PGK) 		4 LEU A  26
PRO A  76
TYR A 120
GLU A 116
 None
 1.03A 6pahA-3zlbA:
undetectable		 6pahA-3zlbA:
22.72
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.
4a22 FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Mycobacterium
tuberculosis) 		PF01116
(F_bP_aldolase) 		4 LEU A 158
HIS A  96
HIS A 252
GLU A 161
 None
ZN  A1348 ( 3.4A)
ZN  A1348 (-3.2A)
None
 1.07A 6pahA-4a22A:
undetectable		 6pahA-4a22A:
21.96
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.
4are COLLAGENASE G

(Hathewaya
histolytica) 		PF01752
(Peptidase_M9)
PF08453
(Peptidase_M9_N) 		4 PRO A 572
HIS A 615
HIS A 660
GLU A 619
 None
 1.08A 6pahA-4areA:
undetectable		 6pahA-4areA:
17.86
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.
4b29 DIMETHYLSULFONIOPROP
IONATE LYASE

(Roseovarius
nubinhibens) 		PF16867
(DMSP_lyase) 		5 PRO A 192
HIS A 129
HIS A 168
TYR A 135
GLU A 133
 PO4  A1197 (-4.2A)
ZN  A1205 ( 3.2A)
ZN  A1205 ( 3.2A)
EDO  A1201 ( 4.1A)
ZN  A1205 ( 2.3A)
 1.02A 6pahA-4b29A:
undetectable		 6pahA-4b29A:
19.75
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.
4bpt PHENYLALANINE-4-HYDR
OXYLASE (PAH)
(PHE-4-MONOOXYGENASE
)

(Legionella
pneumophila) 		PF00351
(Biopterin_H) 		4 PRO A 118
HIS A 122
HIS A 127
GLU A 167
 None
None
None
PEG  A1261 (-3.1A)
 0.75A 6pahA-4bptA:
28.4		 6pahA-4bptA:
29.32
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.
4dg5 PHOSPHOGLYCERATE
KINASE

(Staphylococcus
aureus) 		PF00162
(PGK) 		4 LEU A  26
PRO A  76
TYR A 120
GLU A 116
 None
 0.94A 6pahA-4dg5A:
undetectable		 6pahA-4dg5A:
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.
4fys AMINOPEPTIDASE N

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 LEU A 484
HIS A 392
HIS A 388
GLU A 411
 None
 1.00A 6pahA-4fysA:
undetectable		 6pahA-4fysA:
16.12
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.
4g4i 4-O-METHYL-GLUCURONO
YL METHYLESTERASE

(Thermothelomyces
thermophila) 		no annotation 4 LEU A 357
PRO A 350
HIS A 344
GLU A 236
 None
 1.07A 6pahA-4g4iA:
undetectable		 6pahA-4g4iA:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gaa MGC78867 PROTEIN

(Xenopus laevis) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		4 LEU A 387
HIS A 296
HIS A 292
GLU A 315
 None
ZN  A 701 ( 3.4A)
ZN  A 701 ( 3.2A)
ZN  A 701 ( 1.7A)
 0.95A 6pahA-4gaaA:
undetectable		 6pahA-4gaaA:
19.83
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.
4jzy CRYPTOCHROME-1

(Drosophila
melanogaster) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		4 LEU A  64
PRO A 203
HIS A 207
GLU A  85
 None
 0.88A 6pahA-4jzyA:
undetectable		 6pahA-4jzyA:
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.
4k7c AMINOPEPTIDASE C

(Lactobacillus
rhamnosus) 		PF03051
(Peptidase_C1_2) 		4 LEU A 309
HIS A  81
TYR A 396
GLU A 384
 None
 0.90A 6pahA-4k7cA:
undetectable		 6pahA-4k7cA:
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.
4kxb GLUTAMYL
AMINOPEPTIDASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 LEU A 486
HIS A 397
HIS A 393
GLU A 416
 None
ZN  A1001 ( 3.2A)
ZN  A1001 ( 3.3A)
ZN  A1001 ( 2.4A)
 1.02A 6pahA-4kxbA:
undetectable		 6pahA-4kxbA:
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.
4l5n EARLY PROTEIN GP1B
URACIL-DNA
GLYCOSYLASE

(Bacillus virus
phi29;
Human
alphaherpesvirus
1) 		PF03167
(UDG)
no annotation 		4 HIS A  91
HIS A  92
TYR C  24
GLU C  26
 None
 1.04A 6pahA-4l5nA:
undetectable		 6pahA-4l5nA:
22.51
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.
4la2 DIMETHYLSULPHONIOPRO
PIONATE (DMSP) LYASE
DDDQ

(Ruegeria
lacuscaerulensis) 		PF16867
(DMSP_lyase) 		4 PRO A 187
HIS A 125
HIS A 163
GLU A 129
 MES  A 202 (-4.2A)
ZN  A 201 ( 3.4A)
ZN  A 201 ( 3.3A)
ZN  A 201 ( 1.9A)
 1.01A 6pahA-4la2A:
undetectable		 6pahA-4la2A:
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.
4ml9 UNCHARACTERIZED
PROTEIN

(Sebaldella
termitidis) 		PF00977
(His_biosynth) 		4 LEU A 225
HIS A 139
HIS A 137
GLU A 236
 None
MG  A 301 ( 3.7A)
MG  A 301 ( 3.2A)
MG  A 301 (-1.9A)
 0.99A 6pahA-4ml9A:
undetectable		 6pahA-4ml9A:
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.
4p53 CYCLASE

(Streptomyces
hygroscopicus) 		PF01761
(DHQ_synthase) 		4 LEU A 267
HIS A 284
HIS A 300
GLU A 213
 None
ZN  A 501 (-3.3A)
ZN  A 501 (-3.1A)
ZN  A 501 (-2.6A)
 1.01A 6pahA-4p53A:
undetectable		 6pahA-4p53A:
21.77
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.
4pj6 LEUCYL-CYSTINYL
AMINOPEPTIDASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 LEU A 556
HIS A 468
HIS A 464
GLU A 487
 None
ZN  A1101 (-3.2A)
ZN  A1101 ( 3.2A)
ZN  A1101 ( 1.9A)
 0.94A 6pahA-4pj6A:
undetectable		 6pahA-4pj6A:
17.36
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.
4q1v PUTATIVE DIPEPTIDYL
AMINOPEPTIDASE IV

(Bacteroides
ovatus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 LEU A 571
PRO A 521
HIS A 522
GLU A 315
 None
 0.93A 6pahA-4q1vA:
undetectable		 6pahA-4q1vA:
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.
4uym 14-ALPHA STEROL
DEMETHYLASE

(Aspergillus
fumigatus) 		PF00067
(p450) 		4 LEU A 323
PRO A 421
HIS A 422
GLU A 332
 None
 1.05A 6pahA-4uymA:
undetectable		 6pahA-4uymA:
23.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4v06 TRYPTOPHAN
5-HYDROXYLASE 2

(Homo sapiens) 		PF00351
(Biopterin_H) 		5 PRO A 314
HIS A 318
HIS A 323
TYR A 358
GLU A 363
 IMD  A 600 ( 4.7A)
FE  A1491 ( 3.5A)
FE  A1491 ( 3.3A)
None
FE  A1491 ( 2.0A)
 0.48A 6pahA-4v06A:
47.7		 6pahA-4v06A:
64.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wgk NEUTRAL CERAMIDASE

(Homo sapiens) 		PF04734
(Ceramidase_alk)
PF17048
(Ceramidse_alk_C) 		4 HIS A 303
HIS A 194
TYR A 576
GLU A 540
 ZN  A 801 ( 3.2A)
ZN  A 801 ( 3.3A)
None
ZN  A 801 ( 2.0A)
 0.96A 6pahA-4wgkA:
undetectable		 6pahA-4wgkA:
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.
4wz9 AGAP004809-PA

(Anopheles
gambiae) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 LEU A 459
HIS A 370
HIS A 366
GLU A 389
 None
ZN  A1001 (-3.2A)
ZN  A1001 (-3.3A)
ZN  A1001 (-2.4A)
 0.92A 6pahA-4wz9A:
undetectable		 6pahA-4wz9A:
15.51
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.
5a3k PUTATIVE
PTERIDINE-DEPENDENT
DIOXYGENASE

(Streptomyces
hygroscopicus) 		no annotation 4 LEU A 185
PRO A 169
HIS A 195
HIS A 193
 None
 1.11A 6pahA-5a3kA:
undetectable		 6pahA-5a3kA:
21.25
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.
5a3y THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 HIS A 142
HIS A 146
TYR A 157
GLU A 166
 ZN  A1317 (-3.2A)
ZN  A1317 (-3.2A)
None
ZN  A1317 (-2.3A)
 0.87A 6pahA-5a3yA:
undetectable		 6pahA-5a3yA:
19.07
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.
5bp8 ENT-COPALYL
DIPHOSPHATE SYNTHASE

(Streptomyces
platensis) 		PF00432
(Prenyltrans)
PF13243
(SQHop_cyclase_C) 		4 PRO A 508
HIS A 404
TYR A 459
GLU A 455
 None
 0.97A 6pahA-5bp8A:
undetectable		 6pahA-5bp8A:
21.08
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.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
NON-CATALYTIC
SUBUNIT TRM6

(Homo sapiens) 		PF04189
(Gcd10p) 		4 LEU B 454
PRO B 380
HIS B 379
GLU B 409
 None
 0.87A 6pahA-5ccxB:
undetectable		 6pahA-5ccxB:
20.04
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.
5cu1 DMSP LYASE

(Ruegeria
pomeroyi) 		PF16867
(DMSP_lyase) 		5 PRO A 192
HIS A 130
HIS A 169
TYR A 136
GLU A 134
 None
FE  A 301 (-3.6A)
FE  A 301 (-3.4A)
None
FE  A 301 (-2.1A)
 1.11A 6pahA-5cu1A:
undetectable		 6pahA-5cu1A:
21.32
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.
5e3c DIPEPTIDYL PEPTIDASE
3

(Homo sapiens) 		PF03571
(Peptidase_M49) 		4 LEU A 625
HIS A 455
HIS A 450
GLU A 508
 None
ZN  A 801 (-3.3A)
ZN  A 801 (-3.2A)
ZN  A 801 (-2.2A)
 0.72A 6pahA-5e3cA:
undetectable		 6pahA-5e3cA:
17.29
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.
5f15 4-AMINO-4-DEOXY-L-AR
ABINOSE (L-ARA4N)
TRANSFERASE

(Cupriavidus
metallidurans) 		PF13231
(PMT_2) 		4 LEU A 157
HIS A 488
TYR A  77
GLU A 506
 None
 1.10A 6pahA-5f15A:
undetectable		 6pahA-5f15A:
19.38
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.
5fxn THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 HIS A 142
HIS A 146
TYR A 157
GLU A 166
 ZN  A1317 (-3.2A)
ZN  A1317 (-3.3A)
None
ZN  A1317 (-2.2A)
 0.85A 6pahA-5fxnA:
undetectable		 6pahA-5fxnA:
20.23
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.
5hrm HALOALKYLPHOSPHORUS
HYDROLASE

(Sphingobium sp.
TCM1) 		no annotation 4 LEU A 347
HIS A 258
HIS A 317
GLU A 201
 None
MN  A 602 (-3.2A)
MN  A 602 (-3.2A)
MN  A 602 ( 2.5A)
 0.92A 6pahA-5hrmA:
undetectable		 6pahA-5hrmA:
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.
5im3 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Pseudomonas
aeruginosa) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		4 LEU A 176
HIS A 247
HIS A 248
GLU A 290
 None
 0.95A 6pahA-5im3A:
undetectable		 6pahA-5im3A:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j6s ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 2

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 LEU A 462
HIS A 374
HIS A 370
GLU A 393
 None
ZN  A1001 ( 3.2A)
ZN  A1001 ( 3.2A)
ZN  A1001 ( 1.7A)
 1.04A 6pahA-5j6sA:
undetectable		 6pahA-5j6sA:
16.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jk6 PHENYLALANINE-4-HYDR
OXYLASE

(Dictyostelium
discoideum) 		PF00351
(Biopterin_H) 		5 LEU A 236
PRO A 269
HIS A 273
HIS A 278
TYR A 313
 None
None
FE  A 502 (-3.2A)
FE  A 502 (-3.2A)
None
 0.80A 6pahA-5jk6A:
47.6		 6pahA-5jk6A:
48.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jk6 PHENYLALANINE-4-HYDR
OXYLASE

(Dictyostelium
discoideum) 		PF00351
(Biopterin_H) 		5 PRO A 269
HIS A 273
HIS A 278
TYR A 313
GLU A 318
 None
FE  A 502 (-3.2A)
FE  A 502 (-3.2A)
None
FE  A 502 (-2.1A)
 0.42A 6pahA-5jk6A:
47.6		 6pahA-5jk6A:
48.04
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.
5kd5 METALLOPEPTIDASE

(Bacteroides
thetaiotaomicron) 		PF13402
(Peptidase_M60)
PF17291
(M60-like_N) 		4 HIS A 574
HIS A 578
TYR A 723
GLU A 591
 ZN  A 901 ( 3.3A)
ZN  A 901 ( 3.2A)
None
ZN  A 901 ( 2.3A)
 0.92A 6pahA-5kd5A:
undetectable		 6pahA-5kd5A:
19.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5l01 TRYPTOPHAN
5-HYDROXYLASE 1

(Homo sapiens) 		PF00351
(Biopterin_H) 		5 PRO A 268
HIS A 272
HIS A 277
TYR A 312
GLU A 317
 6Z4  A 502 (-3.8A)
FE  A 501 ( 3.2A)
FE  A 501 (-3.3A)
6Z4  A 502 ( 4.6A)
FE  A 501 ( 1.8A)
 0.61A 6pahA-5l01A:
42.9		 6pahA-5l01A:
65.91
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 4 HIS B 403
HIS B 220
TYR B 327
GLU B 450
 None
 1.11A 6pahA-5nd1B:
undetectable		 6pahA-5nd1B:
15.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tfz DIMETHYLSULFONIOPROP
IONATE LYASE DDDK

(Candidatus
Pelagibacter
ubique) 		PF07883
(Cupin_2) 		4 HIS A  58
HIS A  96
TYR A  64
GLU A  62
 NI  A 201 ( 3.3A)
NI  A 201 ( 3.5A)
7BC  A 202 (-4.6A)
7BC  A 202 ( 2.4A)
 0.96A 6pahA-5tfzA:
undetectable		 6pahA-5tfzA:
18.33
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.
5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Danio rerio) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		4 LEU A 557
PRO A 573
HIS A 608
GLU A 582
 None
 1.07A 6pahA-5w81A:
undetectable		 6pahA-5w81A:
11.47
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.
5x8g 2-SUCCINYLBENZOATE--
COA LIGASE

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 LEU A 386
HIS A 196
TYR A 452
GLU A 392
 None
S0N  A 501 (-4.0A)
None
S0N  A 501 (-4.0A)
 0.93A 6pahA-5x8gA:
undetectable		 6pahA-5x8gA:
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.
5yfb DIPEPTIDYL PEPTIDASE
3

(Armillaria
tabescens) 		no annotation 4 HIS A 443
HIS A 448
TYR A 313
GLU A 501
 ZN  A 801 (-3.2A)
ZN  A 801 (-3.1A)
None
ZN  A 801 (-2.0A)
 0.97A 6pahA-5yfbA:
undetectable		 6pahA-5yfbA:
13.31
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.
5yfb DIPEPTIDYL PEPTIDASE
3

(Armillaria
tabescens) 		no annotation 4 LEU A 618
HIS A 448
HIS A 443
GLU A 501
 None
ZN  A 801 (-3.1A)
ZN  A 801 (-3.2A)
ZN  A 801 (-2.0A)
 0.79A 6pahA-5yfbA:
undetectable		 6pahA-5yfbA:
13.31
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.
5zkq PLATELET-ACTIVATING
FACTOR
RECEPTOR,ENDOLYSIN,E
NDOLYSIN,PLATELET-AC
TIVATING FACTOR
RECEPTOR

(Escherichia
virus T4;
Homo sapiens) 		no annotation 4 LEU A 279
HIS A   8
HIS A 268
GLU A 259
 9EU  A 501 (-4.5A)
ZN  A 506 (-3.9A)
ZN  A 506 (-3.2A)
ZN  A 506 (-2.4A)
 1.04A 6pahA-5zkqA:
undetectable		 6pahA-5zkqA:
13.52