SIMILAR PATTERNS OF AMINO ACIDS FOR 1MMK_A_H4BA1427

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.
1914 SIGNAL RECOGNITION
PARTICLE 9/14 FUSION
PROTEIN

(Mus musculus) 		PF02290
(SRP14)
PF05486
(SRP9-21) 		5 VAL A2002
LEU A2004
SER A2006
PHE A2009
LEU A2010
 None
 0.92A 1mmkA-1914A:
undetectable		 1mmkA-1914A:
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.
1aw1 TRIOSEPHOSPHATE
ISOMERASE

(Moritella
marina) 		PF00121
(TIM) 		5 VAL A  20
LEU A  49
PHE A  46
LEU A  45
GLU A  17
 None
 1.47A 1mmkA-1aw1A:
undetectable		 1mmkA-1aw1A:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bry BRYODIN I

(Bryonia dioica) 		PF00161
(RIP) 		5 VAL Y 232
LEU Y 195
SER Y 193
LEU Y 241
GLU Y 160
 None
 1.42A 1mmkA-1bryY:
undetectable		 1mmkA-1bryY:
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.
1dlc DELTA-ENDOTOXIN
CRYIIIA

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		5 VAL A 295
LEU A 290
GLU A 639
HIS A 566
TYR A 601
 None
 1.43A 1mmkA-1dlcA:
undetectable		 1mmkA-1dlcA:
20.27
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) 		8 VAL A 245
LEU A 248
LEU A 249
PHE A 254
LEU A 255
HIS A 290
TYR A 325
GLU A 330
 None
HBI  A 700 ( 4.5A)
HBI  A 700 (-4.6A)
HBI  A 700 (-3.6A)
HBI  A 700 (-4.7A)
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
FE  A 425 (-2.5A)
 1.01A 1mmkA-1dmwA:
42.9		 1mmkA-1dmwA:
100.00
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) 		8 VAL A 245
LEU A 248
LEU A 249
SER A 251
PHE A 254
LEU A 255
HIS A 290
TYR A 325
 None
HBI  A 700 ( 4.5A)
HBI  A 700 (-4.6A)
HBI  A 700 (-3.6A)
HBI  A 700 (-3.6A)
HBI  A 700 (-4.7A)
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
 0.94A 1mmkA-1dmwA:
42.9		 1mmkA-1dmwA:
100.00
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) 		8 VAL A 245
LEU A 249
PHE A 254
LEU A 255
GLU A 286
HIS A 290
TYR A 325
GLU A 330
 None
HBI  A 700 (-4.6A)
HBI  A 700 (-3.6A)
HBI  A 700 (-4.7A)
None
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
FE  A 425 (-2.5A)
 0.90A 1mmkA-1dmwA:
42.9		 1mmkA-1dmwA:
100.00
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) 		8 VAL A 245
LEU A 249
SER A 251
PHE A 254
LEU A 255
GLU A 286
HIS A 290
TYR A 325
 None
HBI  A 700 (-4.6A)
HBI  A 700 (-3.6A)
HBI  A 700 (-3.6A)
HBI  A 700 (-4.7A)
None
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
 0.88A 1mmkA-1dmwA:
42.9		 1mmkA-1dmwA:
100.00
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) 		8 VAL A 245
PHE A 254
LEU A 255
GLU A 286
HIS A 290
TYR A 325
TRP A 326
GLU A 330
 None
HBI  A 700 (-3.6A)
HBI  A 700 (-4.7A)
None
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
None
FE  A 425 (-2.5A)
 0.95A 1mmkA-1dmwA:
42.9		 1mmkA-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.
1e7s GDP-FUCOSE
SYNTHETASE

(Escherichia
coli) 		PF01370
(Epimerase) 		5 VAL A 224
LEU A 290
LEU A 285
HIS A 242
TYR A 111
 None
 1.47A 1mmkA-1e7sA:
undetectable		 1mmkA-1e7sA:
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.
1eb3 5-AMINOLAEVULINIC
ACID DEHYDRATASE

(Saccharomyces
cerevisiae) 		PF00490
(ALAD) 		5 LEU A 335
PHE A  43
LEU A  45
GLU A 333
TYR A  74
 None
 1.08A 1mmkA-1eb3A:
undetectable		 1mmkA-1eb3A:
22.86
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.
1f1x HOMOPROTOCATECHUATE
2,3-DIOXYGENASE

(Brevibacterium
fuscum) 		PF00903
(Glyoxalase) 		5 VAL A  24
LEU A  74
LEU A 312
LEU A 314
GLU A 127
 None
 1.12A 1mmkA-1f1xA:
undetectable		 1mmkA-1f1xA:
20.52
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.
1ij5 PLASMODIAL SPECIFIC
LAV1-2 PROTEIN

(Physarum
polycephalum) 		PF13202
(EF-hand_5) 		5 VAL A 348
LEU A 195
PHE A 196
LEU A 180
HIS A 279
 None
 1.41A 1mmkA-1ij5A:
undetectable		 1mmkA-1ij5A:
22.75
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.
1j6u UDP-N-ACETYLMURAMATE
-ALANINE LIGASE MURC

(Thermotoga
maritima) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 VAL A 123
LEU A 288
LEU A 291
LEU A 271
TYR A 231
 None
 1.24A 1mmkA-1j6uA:
undetectable		 1mmkA-1j6uA:
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.
1ldj CULLIN HOMOLOG 1

(Homo sapiens) 		PF00888
(Cullin)
PF10557
(Cullin_Nedd8) 		5 VAL A 205
LEU A 279
PHE A 236
LEU A 237
GLU A 271
 None
 1.37A 1mmkA-1ldjA:
undetectable		 1mmkA-1ldjA:
18.91
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.
1ltz PHENYLALANINE-4-HYDR
OXYLASE

(Chromobacterium
violaceum) 		PF00351
(Biopterin_H) 		5 LEU A 101
LEU A 111
HIS A 143
TYR A 179
GLU A 184
 HBI  A 500 ( 4.5A)
None
FE  A 400 (-3.4A)
HBI  A 500 ( 4.0A)
FE  A 400 (-1.9A)
 1.47A 1mmkA-1ltzA:
26.6		 1mmkA-1ltzA:
27.75
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.
1ltz PHENYLALANINE-4-HYDR
OXYLASE

(Chromobacterium
violaceum) 		PF00351
(Biopterin_H) 		5 VAL A  98
HIS A 143
TYR A 179
TRP A 180
GLU A 184
 None
FE  A 400 (-3.4A)
HBI  A 500 ( 4.0A)
None
FE  A 400 (-1.9A)
 0.94A 1mmkA-1ltzA:
26.6		 1mmkA-1ltzA:
27.75
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.
1ltz PHENYLALANINE-4-HYDR
OXYLASE

(Chromobacterium
violaceum) 		PF00351
(Biopterin_H) 		5 VAL A  98
LEU A 101
HIS A 143
TYR A 179
GLU A 184
 None
HBI  A 500 ( 4.5A)
FE  A 400 (-3.4A)
HBI  A 500 ( 4.0A)
FE  A 400 (-1.9A)
 0.70A 1mmkA-1ltzA:
26.6		 1mmkA-1ltzA:
27.75
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.
1ltz PHENYLALANINE-4-HYDR
OXYLASE

(Chromobacterium
violaceum) 		PF00351
(Biopterin_H) 		5 VAL A  98
LEU A 101
PHE A 107
TYR A 179
GLU A 184
 None
HBI  A 500 ( 4.5A)
HBI  A 500 (-3.8A)
HBI  A 500 ( 4.0A)
FE  A 400 (-1.9A)
 1.05A 1mmkA-1ltzA:
26.6		 1mmkA-1ltzA:
27.75
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.
1ltz PHENYLALANINE-4-HYDR
OXYLASE

(Chromobacterium
violaceum) 		PF00351
(Biopterin_H) 		5 VAL A  98
PHE A 107
TYR A 179
TRP A 180
GLU A 184
 None
HBI  A 500 (-3.8A)
HBI  A 500 ( 4.0A)
None
FE  A 400 (-1.9A)
 1.21A 1mmkA-1ltzA:
26.6		 1mmkA-1ltzA:
27.75
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.
1lxt PHOSPHOGLUCOMUTASE
(DEPHOSPHO FORM)

(Oryctolagus
cuniculus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 VAL A 408
LEU A 401
SER A 399
LEU A 207
TRP A 392
 None
 1.43A 1mmkA-1lxtA:
undetectable		 1mmkA-1lxtA:
19.34
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) 		9 VAL A 245
LEU A 248
LEU A 249
PHE A 254
LEU A 255
GLU A 286
HIS A 290
TYR A 325
GLU A 330
 None
None
None
None
None
None
FE  A 501 ( 3.7A)
None
FE  A 501 ( 2.8A)
 0.90A 1mmkA-1phzA:
41.9		 1mmkA-1phzA:
95.08
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) 		9 VAL A 245
LEU A 248
LEU A 249
SER A 251
PHE A 254
LEU A 255
GLU A 286
HIS A 290
TYR A 325
 None
None
None
None
None
None
None
FE  A 501 ( 3.7A)
None
 0.81A 1mmkA-1phzA:
41.9		 1mmkA-1phzA:
95.08
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) 		8 VAL A 245
PHE A 254
LEU A 255
GLU A 286
HIS A 290
TYR A 325
TRP A 326
GLU A 330
 None
None
None
None
FE  A 501 ( 3.7A)
None
None
FE  A 501 ( 2.8A)
 1.01A 1mmkA-1phzA:
41.9		 1mmkA-1phzA:
95.08
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.
1q51 MENB

(Mycobacterium
tuberculosis) 		PF00378
(ECH_1) 		5 TYR A  70
VAL A 168
LEU A 142
PHE A 145
LEU A 277
 None
 1.38A 1mmkA-1q51A:
undetectable		 1mmkA-1q51A:
21.45
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.
1sfr ANTIGEN 85-A

(Mycobacterium
tuberculosis) 		PF00756
(Esterase) 		5 LEU A 133
SER A 131
LEU A  39
HIS A 139
GLU A  98
 None
 1.21A 1mmkA-1sfrA:
undetectable		 1mmkA-1sfrA:
20.41
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.
1tcs TRICHOSANTHIN

(Trichosanthes
kirilowii) 		PF00161
(RIP) 		5 VAL A 232
LEU A 195
SER A 193
LEU A 241
GLU A 160
 None
None
NDP  A 280 (-2.8A)
None
NDP  A 280 ( 2.7A)
 1.36A 1mmkA-1tcsA:
undetectable		 1mmkA-1tcsA:
22.15
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.
1tzq EQUINATOXIN II

(Actinia equina) 		PF06369
(Anemone_cytotox) 		5 VAL A  65
LEU A  72
LEU A  71
HIS A 175
GLU A 173
 None
 1.42A 1mmkA-1tzqA:
undetectable		 1mmkA-1tzqA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w0a ALPHA-HEMOGLOBIN
STABILIZING PROTEIN

(Homo sapiens) 		PF09236
(AHSP) 		5 VAL A  56
LEU A  10
SER A  12
LEU A  15
GLU A  62
 None
 0.99A 1mmkA-1w0aA:
undetectable		 1mmkA-1w0aA:
13.98
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.
1wqa PHOSPHO-SUGAR MUTASE

(Pyrococcus
horikoshii) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 LEU A 310
LEU A 338
GLU A 123
TYR A 317
GLU A 318
 LEU  A 310 ( 0.6A)
LEU  A 338 ( 0.6A)
GLU  A 123 ( 0.6A)
TYR  A 317 ( 1.3A)
GLU  A 318 ( 0.6A)
 1.17A 1mmkA-1wqaA:
undetectable		 1mmkA-1wqaA:
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.
1x9d ENDOPLASMIC
RETICULUM
MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E

(Homo sapiens) 		PF01532
(Glyco_hydro_47) 		5 TYR A 606
LEU A 403
GLU A 663
TYR A 468
GLU A 467
 None
None
SMD  A1003 (-2.9A)
None
CA  A1001 ( 4.2A)
 1.20A 1mmkA-1x9dA:
undetectable		 1mmkA-1x9dA:
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.
2amc PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Thermus
thermophilus) 		PF01409
(tRNA-synt_2d)
PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		5 VAL B  12
LEU B 180
LEU B 177
GLU B  16
GLU B  23
 None
 1.41A 1mmkA-2amcB:
undetectable		 1mmkA-2amcB:
18.34
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.
2cwo RNA SILENCING
SUPPRESSOR

(Beet yellows
virus) 		PF11479
(Suppressor_P21) 		5 VAL A 132
LEU A 125
LEU A 165
SER A 169
LEU A 173
 None
 1.39A 1mmkA-2cwoA:
undetectable		 1mmkA-2cwoA:
19.76
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.
2gow UBIQUITIN-LIKE
PROTEIN 3

(Homo sapiens) 		PF13881
(Rad60-SLD_2) 		5 LEU A  73
SER A  27
PHE A  26
LEU A  25
HIS A  38
 None
 1.32A 1mmkA-2gowA:
undetectable		 1mmkA-2gowA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hly HYPOTHETICAL PROTEIN
ATU2299

(Agrobacterium
fabrum) 		PF09641
(DUF2026) 		5 TYR A  12
PHE A 105
LEU A  64
HIS A  88
TYR A  62
 None
 1.39A 1mmkA-2hlyA:
undetectable		 1mmkA-2hlyA:
20.18
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.
2hyj PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00440
(TetR_N) 		5 VAL A 129
LEU A 110
LEU A  64
LEU A  59
GLU A 117
 None
 1.18A 1mmkA-2hyjA:
undetectable		 1mmkA-2hyjA:
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.
2qiw PEP PHOSPHONOMUTASE

(Corynebacterium
glutamicum) 		PF13714
(PEP_mutase) 		5 VAL A  26
LEU A  23
LEU A  43
SER A  41
PHE A  40
 None
None
None
GOL  A 258 (-3.7A)
None
 1.15A 1mmkA-2qiwA:
undetectable		 1mmkA-2qiwA:
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.
2qzx CANDIDAPEPSIN-5

(Candida
albicans) 		PF00026
(Asp) 		5 VAL A 196
LEU A 194
LEU A 217
SER A 219
LEU A 159
 None
 1.34A 1mmkA-2qzxA:
undetectable		 1mmkA-2qzxA:
22.28
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.
2qzx CANDIDAPEPSIN-5

(Candida
albicans) 		PF00026
(Asp) 		5 VAL A 196
LEU A 216
LEU A 217
SER A 219
LEU A 157
 None
 1.26A 1mmkA-2qzxA:
undetectable		 1mmkA-2qzxA:
22.28
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.
2rsp RSV PROTEASE

(Rous sarcoma
virus) 		PF00077
(RVP) 		5 VAL A  13
LEU A  35
LEU A  36
SER A  38
LEU A 121
 None
 1.14A 1mmkA-2rspA:
undetectable		 1mmkA-2rspA:
16.26
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) 		8 LEU A 294
LEU A 295
LEU A 301
GLU A 332
HIS A 336
TYR A 371
TRP A 372
GLU A 376
 HBI  A 500 (-4.7A)
HBI  A 500 (-4.2A)
MTY  A 300 ( 4.2A)
HBI  A 500 (-3.2A)
FE  A 501 ( 3.4A)
MTY  A 300 (-3.9A)
None
FE  A 501 (-2.1A)
 1.00A 1mmkA-2tohA:
43.0		 1mmkA-2tohA:
59.47
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) 		8 VAL A 291
LEU A 294
LEU A 295
LEU A 301
GLU A 332
HIS A 336
TRP A 372
GLU A 376
 HBI  A 500 ( 4.6A)
HBI  A 500 (-4.7A)
HBI  A 500 (-4.2A)
MTY  A 300 ( 4.2A)
HBI  A 500 (-3.2A)
FE  A 501 ( 3.4A)
None
FE  A 501 (-2.1A)
 0.94A 1mmkA-2tohA:
43.0		 1mmkA-2tohA:
59.47
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.
2vqa SLL1358 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00190
(Cupin_1) 		5 VAL A 176
LEU A 100
LEU A 121
HIS A 103
GLU A 108
 None
None
None
MN  A1005 (-3.5A)
MN  A1005 (-2.5A)
 1.25A 1mmkA-2vqaA:
undetectable		 1mmkA-2vqaA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wj3 1-H-3-HYDROXY-4-OXOQ
UINALDINE
2,4-DIOXYGENASE

(Paenarthrobacter
nitroguajacolicus) 		PF00561
(Abhydrolase_1) 		5 TYR A 227
VAL A 159
PHE A 136
HIS A 102
TYR A 196
 None
 1.17A 1mmkA-2wj3A:
undetectable		 1mmkA-2wj3A:
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.
2y7c TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN

(Escherichia
coli) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		5 VAL B 310
LEU B 355
PHE B 356
TYR B 405
TRP B 447
 None
 1.42A 1mmkA-2y7cB:
undetectable		 1mmkA-2y7cB:
19.63
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.
2yik ENDOGLUCANASE

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9) 		5 LEU A 329
LEU A 291
HIS A 409
TYR A 139
GLU A 140
 None
 1.43A 1mmkA-2yikA:
undetectable		 1mmkA-2yikA:
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.
3a79 TOLL-LIKE RECEPTOR
6, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Mus musculus) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		5 VAL B 211
LEU B 178
SER B 154
LEU B 153
GLU B 189
 None
 1.16A 1mmkA-3a79B:
undetectable		 1mmkA-3a79B:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g77 CYTOSINE DEAMINASE

(Escherichia
coli) 		PF07969
(Amidohydro_3) 		5 VAL A 226
LEU A 261
SER A 259
PHE A 262
GLU A 300
 None
 1.20A 1mmkA-3g77A:
undetectable		 1mmkA-3g77A:
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.
3gz8 MUTT/NUDIX FAMILY
PROTEIN

(Shewanella
oneidensis) 		PF00293
(NUDIX) 		5 VAL A  90
LEU A  87
LEU A 145
LEU A 143
GLU A 151
 None
 1.26A 1mmkA-3gz8A:
undetectable		 1mmkA-3gz8A:
19.20
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.
3h74 PYRIDOXAL KINASE

(Lactobacillus
plantarum) 		PF08543
(Phos_pyr_kin) 		5 VAL A   6
LEU A  18
SER A  11
LEU A  40
HIS A 279
 None
 1.46A 1mmkA-3h74A:
undetectable		 1mmkA-3h74A:
22.79
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 TYR A 235
GLU A 273
HIS A 277
TYR A 312
GLU A 317
 ML0  A 401 (-3.9A)
FE  A 400 ( 4.6A)
FE  A 400 (-3.2A)
None
FE  A 400 ( 1.9A)
 1.19A 1mmkA-3hf8A:
40.7		 1mmkA-3hf8A:
64.98
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) 		8 VAL A 232
LEU A 236
PHE A 241
LEU A 242
GLU A 273
HIS A 277
TYR A 312
GLU A 317
 None
None
None
None
FE  A 400 ( 4.6A)
FE  A 400 (-3.2A)
None
FE  A 400 ( 1.9A)
 0.88A 1mmkA-3hf8A:
40.7		 1mmkA-3hf8A:
64.98
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.
3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE

(Escherichia
coli) 		PF00581
(Rhodanese) 		5 LEU A 254
LEU A 145
HIS A 354
TYR A 397
GLU A 393
 None
 0.83A 1mmkA-3ipoA:
undetectable		 1mmkA-3ipoA:
19.67
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.
3o7b RIBOSOME BIOGENESIS
NEP1 RNA
METHYLTRANSFERASE

(Archaeoglobus
fulgidus) 		PF03587
(EMG1) 		5 VAL A  94
LEU A  73
SER A  75
LEU A 207
TYR A 210
 None
 1.36A 1mmkA-3o7bA:
undetectable		 1mmkA-3o7bA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o82 PEPTIDE ARYLATION
ENZYME

(Acinetobacter
baumannii) 		PF00501
(AMP-binding) 		5 LEU A  62
LEU A  59
SER A  55
LEU A  45
GLU A  90
 None
 1.20A 1mmkA-3o82A:
undetectable		 1mmkA-3o82A:
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.
3opb SWI5-DEPENDENT HO
EXPRESSION PROTEIN 4

(Saccharomyces
cerevisiae) 		PF11701
(UNC45-central) 		5 LEU A 231
SER A 243
PHE A 246
LEU A 247
TYR A 287
 None
 1.33A 1mmkA-3opbA:
undetectable		 1mmkA-3opbA:
18.34
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.
3qdk RIBULOKINASE

(Bacillus
halodurans) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 VAL A 284
LEU A 302
LEU A 303
HIS A 441
GLU A 439
 None
 1.39A 1mmkA-3qdkA:
undetectable		 1mmkA-3qdkA:
22.03
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.
3rht (GATASE1)-LIKE
PROTEIN

(Planctopirus
limnophila) 		PF07090
(GATase1_like) 		5 VAL A  80
PHE A 244
LEU A  22
TYR A 240
TRP A 219
 None
 1.34A 1mmkA-3rhtA:
undetectable		 1mmkA-3rhtA:
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.
3rxz POLYSACCHARIDE
DEACETYLASE

(Mycolicibacterium
smegmatis) 		PF01522
(Polysacc_deac_1) 		5 TYR A 141
VAL A 178
LEU A 156
HIS A 151
GLU A 119
 None
 1.15A 1mmkA-3rxzA:
undetectable		 1mmkA-3rxzA:
22.29
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.
3tal DNA DOUBLE-STRAND
BREAK REPAIR PROTEIN
NURA

(Pyrococcus
furiosus) 		PF09376
(NurA) 		5 TYR A 294
LEU A 129
LEU A 280
TYR A 279
GLU A 102
 None
None
None
None
GOL  A 454 (-4.0A)
 1.36A 1mmkA-3talA:
undetectable		 1mmkA-3talA:
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.
3uyq CARBONIC ANHYDRASE 3

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		5 LEU A 240
LEU A 228
LEU A  60
HIS A  94
TRP A   5
 None
None
None
ZN  A 261 (-3.3A)
None
 1.41A 1mmkA-3uyqA:
undetectable		 1mmkA-3uyqA:
18.69
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.
3vwa CYTOPLASMIC EXPORT
PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 5 VAL A 140
LEU A 120
SER A 118
LEU A 115
TYR A 248
 None
 1.47A 1mmkA-3vwaA:
undetectable		 1mmkA-3vwaA:
19.46
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.
3wzf ASPARTATE
AMINOTRANSFERASE,
CYTOPLASMIC

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		5 TYR A 134
VAL A 211
LEU A 177
LEU A 174
LEU A 168
 None
 1.38A 1mmkA-3wzfA:
undetectable		 1mmkA-3wzfA:
22.56
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.
4bpt PHENYLALANINE-4-HYDR
OXYLASE (PAH)
(PHE-4-MONOOXYGENASE
)

(Legionella
pneumophila) 		PF00351
(Biopterin_H) 		5 PHE A  91
GLU A 123
HIS A 127
TRP A 163
GLU A 167
 PEG  A1260 (-3.8A)
None
None
PEG  A1262 ( 4.4A)
PEG  A1261 (-3.1A)
 0.89A 1mmkA-4bptA:
26.5		 1mmkA-4bptA:
28.53
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.
4bpt PHENYLALANINE-4-HYDR
OXYLASE (PAH)
(PHE-4-MONOOXYGENASE
)

(Legionella
pneumophila) 		PF00351
(Biopterin_H) 		5 VAL A  82
PHE A  91
GLU A 123
HIS A 127
GLU A 167
 None
PEG  A1260 (-3.8A)
None
None
PEG  A1261 (-3.1A)
 0.94A 1mmkA-4bptA:
26.5		 1mmkA-4bptA:
28.53
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.
4cdo THIOREDOXIN-LIKE
PROTEIN 4A,
POLYGLUTAMINE-BINDIN
G PROTEIN

(Homo sapiens) 		PF02966
(DIM1) 		5 VAL A  27
LEU A   5
LEU A  45
SER A  47
GLU A  50
 None
 1.48A 1mmkA-4cdoA:
undetectable		 1mmkA-4cdoA:
19.63
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.
4d9r COMPLEMENT FACTOR D

(Homo sapiens) 		PF00089
(Trypsin) 		5 VAL A 212
LEU A 104
LEU A 103
SER A  94
GLU A  60
 None
 1.32A 1mmkA-4d9rA:
undetectable		 1mmkA-4d9rA:
20.43
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.
4fva 5'-TYROSYL-DNA
PHOSPHODIESTERASE

(Caenorhabditis
elegans) 		PF03372
(Exo_endo_phos) 		5 VAL A 226
LEU A 217
LEU A 228
LEU A 154
TYR A 174
 None
None
None
None
EDO  A 404 ( 3.4A)
 1.47A 1mmkA-4fvaA:
undetectable		 1mmkA-4fvaA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mtl PROTEIN-LYSINE
METHYLTRANSFERASE
METTL21C

(Homo sapiens) 		PF10294
(Methyltransf_16) 		5 VAL A 210
LEU A 205
LEU A 206
PHE A 237
LEU A 234
 None
 1.33A 1mmkA-4mtlA:
undetectable		 1mmkA-4mtlA:
21.36
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.
4nt9 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Streptococcus
pneumoniae) 		no annotation 5 VAL B 211
LEU B 208
LEU B 192
GLU B 152
GLU B 204
 None
None
None
None
ZN  B 301 (-2.7A)
 1.30A 1mmkA-4nt9B:
undetectable		 1mmkA-4nt9B:
20.25
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.
4okm TERPENE SYNTHASE
METAL-BINDING
DOMAIN-CONTAINING
PROTEIN

(Streptomyces
pristinaespiralis) 		no annotation 5 LEU A  60
SER A 293
LEU A 294
TYR A 290
GLU A 192
 None
 1.44A 1mmkA-4okmA:
undetectable		 1mmkA-4okmA:
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.
4ovy HALOACID
DEHALOGENASE DOMAIN
PROTEIN HYDROLASE

(Planctopirus
limnophila) 		PF12710
(HAD) 		5 TYR A 199
VAL A 280
LEU A  70
SER A 184
TRP A 194
 None
None
None
EDO  A 407 ( 4.3A)
None
 1.38A 1mmkA-4ovyA:
undetectable		 1mmkA-4ovyA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p4o DNA POLYMERASE BETA

(Leishmania
infantum) 		PF10391
(DNA_pol_lambd_f)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		5 VAL A 354
LEU A 313
PHE A 314
LEU A 316
GLU A 338
 None
 1.47A 1mmkA-4p4oA:
undetectable		 1mmkA-4p4oA:
23.50
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.
4pay SIDC, INTERAPTIN

(Legionella
pneumophila) 		no annotation 5 VAL A 160
LEU A  42
GLU A 357
HIS A 435
GLU A  39
 None
 1.47A 1mmkA-4payA:
undetectable		 1mmkA-4payA:
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.
4q1v PUTATIVE DIPEPTIDYL
AMINOPEPTIDASE IV

(Bacteroides
ovatus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 VAL A 399
LEU A 380
LEU A 561
HIS A 522
GLU A 315
 None
 1.37A 1mmkA-4q1vA:
undetectable		 1mmkA-4q1vA:
16.95
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.
4umz CYTOCHROME P450
HYDROXYLASE PIKC

(Streptomyces
venezuelae) 		PF00067
(p450) 		5 TYR A 286
VAL A 368
LEU A 259
SER A 261
LEU A 380
 None
 1.43A 1mmkA-4umzA:
undetectable		 1mmkA-4umzA:
21.21
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.
4umz CYTOCHROME P450
HYDROXYLASE PIKC

(Streptomyces
venezuelae) 		PF00067
(p450) 		5 VAL A 368
LEU A 259
SER A 261
LEU A 380
TRP A 389
 None
 1.29A 1mmkA-4umzA:
undetectable		 1mmkA-4umzA:
21.21
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) 		7 VAL A 278
LEU A 282
PHE A 287
GLU A 319
HIS A 323
TYR A 358
GLU A 363
 None
None
IMD  A 600 ( 4.4A)
IMD  A 600 (-3.3A)
FE  A1491 ( 3.3A)
None
FE  A1491 ( 2.0A)
 1.09A 1mmkA-4v06A:
41.8		 1mmkA-4v06A:
61.29
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) 		7 VAL A 278
LEU A 282
PHE A 287
LEU A 288
GLU A 319
HIS A 323
TYR A 358
 None
None
IMD  A 600 ( 4.4A)
None
IMD  A 600 (-3.3A)
FE  A1491 ( 3.3A)
None
 0.99A 1mmkA-4v06A:
41.8		 1mmkA-4v06A:
61.29
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.
4xz6 GLYCINE
BETAINE/PROLINE ABC
TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN

(Ruegeria
pomeroyi) 		PF04069
(OpuAC) 		5 LEU A 269
PHE A 106
HIS A  53
TYR A  87
GLU A  98
 None
TMO  A 401 (-4.4A)
None
None
None
 1.46A 1mmkA-4xz6A:
undetectable		 1mmkA-4xz6A:
22.62
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.
4zas CALS13

(Micromonospora
echinospora) 		PF01041
(DegT_DnrJ_EryC1) 		5 VAL A 139
LEU A 169
LEU A  70
SER A  71
LEU A  68
 None
 1.45A 1mmkA-4zasA:
undetectable		 1mmkA-4zasA:
20.53
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.
4ztb PROTEASE NSP2

(Chikungunya
virus) 		PF01707
(Peptidase_C9) 		5 LEU A 157
LEU A 174
GLU A 291
HIS A 217
TYR A 172
 GOL  A 401 ( 4.8A)
None
None
None
None
 1.39A 1mmkA-4ztbA:
undetectable		 1mmkA-4ztbA:
21.39
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.
5dll AMINOPEPTIDASE N

(Francisella
tularensis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 TYR A 194
LEU A 195
GLU A 307
HIS A 306
GLU A 329
 None
None
ZN  A 901 ( 4.2A)
ZN  A 901 (-3.3A)
ZN  A 901 (-1.6A)
 1.26A 1mmkA-5dllA:
undetectable		 1mmkA-5dllA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fd4 COMR

(Streptococcus
suis) 		PF13560
(HTH_31) 		5 VAL A  15
LEU A  41
SER A  37
TYR A 151
GLU A 120
 None
 1.36A 1mmkA-5fd4A:
undetectable		 1mmkA-5fd4A:
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.
5h76 DARPIN,IMMUNOGLOBULI
N G-BINDING PROTEIN
A

(Staphylococcus
aureus;
synthetic
construct) 		PF02216
(B)
PF12796
(Ank_2) 		5 TYR A 167
VAL A 106
LEU A 133
LEU A 132
LEU A  93
 None
 1.35A 1mmkA-5h76A:
undetectable		 1mmkA-5h76A:
21.85
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.
5j90 RAGB/SUSD DOMAIN
PROTEIN

(Flavobacterium
johnsoniae) 		PF12741
(SusD-like) 		5 LEU A 226
LEU A 183
GLU A 452
HIS A 146
GLU A 143
 None
 1.26A 1mmkA-5j90A:
undetectable		 1mmkA-5j90A:
20.81
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 VAL A 123
LEU A 243
TYR A 313
TRP A 314
GLU A 318
 None
None
None
None
FE  A 502 (-2.1A)
 0.99A 1mmkA-5jk6A:
41.6		 1mmkA-5jk6A:
47.60
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) 		9 VAL A 233
LEU A 236
LEU A 237
PHE A 242
LEU A 243
GLU A 274
HIS A 278
TYR A 313
GLU A 318
 None
None
None
None
None
None
FE  A 502 (-3.2A)
None
FE  A 502 (-2.1A)
 0.82A 1mmkA-5jk6A:
41.6		 1mmkA-5jk6A:
47.60
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) 		8 VAL A 233
PHE A 242
LEU A 243
GLU A 274
HIS A 278
TYR A 313
TRP A 314
GLU A 318
 None
None
None
None
FE  A 502 (-3.2A)
None
None
FE  A 502 (-2.1A)
 0.87A 1mmkA-5jk6A:
41.6		 1mmkA-5jk6A:
47.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ko3 ORF1A

(Middle East
respiratory
syndrome-related
coronavirus) 		PF08715
(Viral_protease) 		5 VAL A  90
LEU A  86
PHE A  83
LEU A  80
TYR A  72
 None
None
ACT  A 402 ( 4.7A)
None
None
 1.32A 1mmkA-5ko3A:
undetectable		 1mmkA-5ko3A:
22.12
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) 		8 VAL A 232
LEU A 236
PHE A 241
LEU A 242
GLU A 273
HIS A 277
TYR A 312
GLU A 317
 None
None
6Z4  A 502 ( 4.8A)
None
FE  A 501 ( 4.8A)
FE  A 501 (-3.3A)
6Z4  A 502 ( 4.6A)
FE  A 501 ( 1.8A)
 0.89A 1mmkA-5l01A:
41.2		 1mmkA-5l01A:
53.63
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.
5l0w SEC71
SEC72

(Chaetomium
thermophilum) 		PF09802
(Sec66)
no annotation 		5 VAL A 115
LEU A  64
LEU A  63
LEU A  39
GLU B  40
 None
 1.26A 1mmkA-5l0wA:
undetectable		 1mmkA-5l0wA:
18.15
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.
5opt 40S RIBOSOMAL
PROTEIN S17,
PUTATIVE
40S RIBOSOMAL
PROTEIN SA

(Trypanosoma
cruzi) 		no annotation 5 VAL f  22
LEU k 164
SER k 162
PHE k 161
HIS k 155
 None
 1.29A 1mmkA-5optf:
undetectable		 1mmkA-5optf:
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.
5u5d (S)-2-HYDROXYPROPYLP
HOSPHONIC ACID
EPOXIDASE

(Pseudomonas
syringae) 		PF07883
(Cupin_2) 		5 LEU A 112
PHE A 173
LEU A 157
HIS A 171
GLU A 132
 TB6  A 302 (-4.2A)
TB6  A 302 (-4.9A)
None
MN  A 301 ( 3.6A)
MN  A 301 ( 2.5A)
 1.35A 1mmkA-5u5dA:
undetectable		 1mmkA-5u5dA:
17.72
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.
5um6 UBIQUITIN-ACTIVATING
ENZYME E1 1

(Schizosaccharomyces
pombe) 		PF00899
(ThiF)
PF09358
(E1_UFD)
PF10585
(UBA_e1_thiolCys)
PF16190
(E1_FCCH)
PF16191
(E1_4HB) 		5 VAL A 416
LEU A 354
SER A 358
LEU A 361
GLU A 130
 None
 1.43A 1mmkA-5um6A:
undetectable		 1mmkA-5um6A:
15.67
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.
5v8f DNA REPLICATION
LICENSING FACTOR
MCM7

(Saccharomyces
cerevisiae) 		PF00493
(MCM)
PF14551
(MCM_N)
PF17207
(MCM_OB) 		5 VAL 7 456
LEU 7 434
LEU 7 432
LEU 7 426
GLU 7 715
 None
 1.28A 1mmkA-5v8f7:
undetectable		 1mmkA-5v8f7:
17.33
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.
6bq6 THERMOSPERMINE
SYNTHASE

(Medicago
truncatula) 		no annotation 5 VAL A 134
LEU A  68
LEU A  59
TYR A  28
GLU A  30
 None
None
None
None
TER  A 402 ( 3.8A)
 1.46A 1mmkA-6bq6A:
undetectable		 1mmkA-6bq6A:
15.50
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.
6c1q SOLUBLE CYTOCHROME
B562, C5A
ANAPHYLATOXIN
CHEMOTACTIC RECEPTOR
1 CHIMERA

(Escherichia
coli;
Homo sapiens) 		no annotation 5 LEU B 354
SER B 357
PHE B 361
LEU B 362
GLU B 285
 None
 1.20A 1mmkA-6c1qB:
undetectable		 1mmkA-6c1qB:
13.69
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.
6c4m YERSINOPINE
DEHYDROGENASE

(Yersinia pestis) 		no annotation 5 VAL C 130
LEU C 119
LEU C 197
TRP C 211
GLU C 208
 None
 1.31A 1mmkA-6c4mC:
undetectable		 1mmkA-6c4mC:
13.25
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.
6d9h CHIMERA PROTEIN OF
MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4 AND
ADENOSINE RECEPTOR
A1

(Homo sapiens) 		no annotation 5 VAL R  83
LEU R  68
HIS R 278
TYR R  12
GLU R  16
 None
None
ADN  R 400 (-4.1A)
None
None
 1.44A 1mmkA-6d9hR:
undetectable		 1mmkA-6d9hR:
13.46