SIMILAR PATTERNS OF AMINO ACIDS FOR 1KW0_A_H4BA429

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
 0.98A 1kw0A-1914A:
undetectable		 1kw0A-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.
1c3c PROTEIN
(ADENYLOSUCCINATE
LYASE)

(Thermotoga
maritima) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		5 VAL A  30
LEU A  92
SER A  94
LEU A  98
THR A  31
 None
 1.29A 1kw0A-1c3cA:
undetectable		 1kw0A-1c3cA:
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.
1cr9 FAB ANTIBODY HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 VAL H 108
LEU H  82
LEU H 106
THR H  83
GLU H  46
 None
 1.33A 1kw0A-1cr9H:
undetectable		 1kw0A-1cr9H:
21.74
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) 		9 VAL A 245
LEU A 248
LEU A 249
PHE A 254
LEU A 255
THR A 266
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)
None
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
FE  A 425 (-2.5A)
 1.05A 1kw0A-1dmwA:
42.7		 1kw0A-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) 		9 VAL A 245
LEU A 248
LEU A 249
SER A 251
PHE A 254
LEU A 255
THR A 266
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)
None
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
 0.98A 1kw0A-1dmwA:
42.7		 1kw0A-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) 		9 VAL A 245
PHE A 254
LEU A 255
THR A 266
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
None
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
None
FE  A 425 (-2.5A)
 0.99A 1kw0A-1dmwA:
42.7		 1kw0A-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
SER A 251
PHE A 254
LEU A 255
THR A 266
GLU A 286
HIS A 290
TYR A 325
 None
HBI  A 700 (-3.6A)
HBI  A 700 (-3.6A)
HBI  A 700 (-4.7A)
None
None
FE  A 425 (-3.3A)
HBI  A 700 (-3.8A)
 0.92A 1kw0A-1dmwA:
42.7		 1kw0A-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
 1.34A 1kw0A-1e7sA:
undetectable		 1kw0A-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
 1.21A 1kw0A-1eb3A:
undetectable		 1kw0A-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
 1.08A 1kw0A-1f1xA:
undetectable		 1kw0A-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.
1ig0 THIAMIN
PYROPHOSPHOKINASE

(Saccharomyces
cerevisiae) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		5 VAL A 131
LEU A 209
SER A 210
LEU A 229
THR A 128
 None
 1.37A 1kw0A-1ig0A:
undetectable		 1kw0A-1ig0A:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.21A 1kw0A-1j6uA:
undetectable		 1kw0A-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.
1ktn 2-DEOXYRIBOSE-5-PHOS
PHATE ALDOLASE

(Escherichia
coli) 		PF01791
(DeoC) 		5 VAL A  40
LEU A   9
SER A   7
LEU A   4
THR A  38
 None
 1.17A 1kw0A-1ktnA:
undetectable		 1kw0A-1ktnA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1

(Paracoccus
denitrificans) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		5 LEU A 325
LEU A 338
SER A 347
LEU A 363
THR A 341
 None
 1.07A 1kw0A-1lrwA:
undetectable		 1kw0A-1lrwA:
18.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
 0.96A 1kw0A-1ltzA:
26.7		 1kw0A-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)
 0.71A 1kw0A-1ltzA:
26.7		 1kw0A-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
THR A 119
GLU A 184
 None
HBI  A 500 ( 4.5A)
HBI  A 500 (-3.8A)
None
FE  A 400 (-1.9A)
 1.09A 1kw0A-1ltzA:
26.7		 1kw0A-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)
 1.10A 1kw0A-1ltzA:
26.7		 1kw0A-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
THR A 119
HIS A 143
GLU A 184
 None
HBI  A 500 ( 4.5A)
None
FE  A 400 (-3.4A)
FE  A 400 (-1.9A)
 0.61A 1kw0A-1ltzA:
26.7		 1kw0A-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
THR A 119
TRP A 180
GLU A 184
 None
HBI  A 500 (-3.8A)
None
None
FE  A 400 (-1.9A)
 1.16A 1kw0A-1ltzA:
26.7		 1kw0A-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)
 1.24A 1kw0A-1ltzA:
26.7		 1kw0A-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
THR A 119
HIS A 143
TRP A 180
GLU A 184
 None
None
FE  A 400 (-3.4A)
None
FE  A 400 (-1.9A)
 0.74A 1kw0A-1ltzA:
26.7		 1kw0A-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.
1mdf 2,3-DIHYDROXYBENZOAT
E-AMP LIGASE

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 VAL A 273
LEU A 227
LEU A 230
THR A 274
TYR A 236
 None
 1.26A 1kw0A-1mdfA:
undetectable		 1kw0A-1mdfA:
21.56
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 VAL A1209
LEU A 846
LEU A 845
LEU A 481
TRP A1080
 None
 1.38A 1kw0A-1ofeA:
undetectable		 1kw0A-1ofeA:
12.65
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) 		10 VAL A 245
LEU A 248
LEU A 249
PHE A 254
LEU A 255
THR A 266
GLU A 286
HIS A 290
TYR A 325
GLU A 330
 None
None
None
None
None
None
None
FE  A 501 ( 3.7A)
None
FE  A 501 ( 2.8A)
 0.90A 1kw0A-1phzA:
41.9		 1kw0A-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) 		10 VAL A 245
LEU A 248
LEU A 249
SER A 251
PHE A 254
LEU A 255
THR A 266
GLU A 286
HIS A 290
TYR A 325
 None
None
None
None
None
None
None
None
FE  A 501 ( 3.7A)
None
 0.84A 1kw0A-1phzA:
41.9		 1kw0A-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
PHE A 254
LEU A 255
THR A 266
GLU A 286
HIS A 290
TYR A 325
TRP A 326
GLU A 330
 None
None
None
None
None
FE  A 501 ( 3.7A)
None
None
FE  A 501 ( 2.8A)
 0.96A 1kw0A-1phzA:
41.9		 1kw0A-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.
1r1a HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP1)
HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP2)

(Rhinovirus A) 		PF00073
(Rhv) 		5 SER 1 211
THR 2 147
HIS 2 217
TYR 1 194
GLU 2 129
 SUC  1 288 ( 4.5A)
None
None
None
None
 1.20A 1kw0A-1r1a1:
undetectable		 1kw0A-1r1a1:
22.95
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.
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
 1.25A 1kw0A-1sfrA:
undetectable		 1kw0A-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.
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
 0.94A 1kw0A-1w0aA:
undetectable		 1kw0A-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.
1w0m TRIOSEPHOSPHATE
ISOMERASE

(Thermoproteus
tenax) 		PF00121
(TIM)
PF05690
(ThiG) 		5 VAL A 199
LEU A 201
SER A 203
THR A 178
HIS A  93
 None
PO4  A1226 (-4.6A)
PO4  A1226 (-2.7A)
None
None
 1.23A 1kw0A-1w0mA:
undetectable		 1kw0A-1w0mA:
20.30
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.
1w6s METHANOL
DEHYDROGENASE
SUBUNIT 1

(Methylobacterium
extorquens) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		5 LEU A 325
LEU A 338
SER A 347
LEU A 363
THR A 341
 None
 1.23A 1kw0A-1w6sA:
undetectable		 1kw0A-1w6sA:
20.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wky ENDO-BETA-1,4-MANNAN
ASE

(Bacillus sp.
JAMB-602) 		PF00150
(Cellulase) 		5 VAL A 151
LEU A 144
SER A 142
THR A 150
GLU A 108
 None
 1.31A 1kw0A-1wkyA:
undetectable		 1kw0A-1wkyA:
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.
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)
 1.08A 1kw0A-1wqaA:
undetectable		 1kw0A-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.
1xr4 PUTATIVE CITRATE
LYASE ALPHA
CHAIN/CITRATE-ACP
TRANSFERASE

(Salmonella
enterica) 		PF04223
(CitF) 		5 VAL A 421
LEU A 368
SER A 366
LEU A 365
THR A 423
 None
 1.04A 1kw0A-1xr4A:
undetectable		 1kw0A-1xr4A:
21.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2acv TRITERPENE
UDP-GLUCOSYL
TRANSFERASE UGT71G1

(Medicago
truncatula) 		PF00201
(UDPGT) 		5 VAL A 217
LEU A 149
PHE A 148
LEU A 151
TYR A 202
 None
 1.36A 1kw0A-2acvA:
undetectable		 1kw0A-2acvA:
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.
2dwc 433AA LONG
HYPOTHETICAL
PHOSPHORIBOSYLGLYCIN
AMIDE FORMYL
TRANSFERASE

(Pyrococcus
horikoshii) 		PF02222
(ATP-grasp) 		5 LEU A 316
LEU A 336
THR A 303
TYR A 260
GLU A 213
 None
 1.36A 1kw0A-2dwcA:
undetectable		 1kw0A-2dwcA:
23.38
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.
2f3o PYRUVATE
FORMATE-LYASE 2

(Archaeoglobus
fulgidus) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 LEU A 587
LEU A 586
SER A 647
LEU A 645
GLU A 653
 None
 1.25A 1kw0A-2f3oA:
undetectable		 1kw0A-2f3oA:
16.84
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.
2hj0 PUTATIVE CITRATE
LYASE, ALFA SUBUNIT

(Streptococcus
mutans) 		PF04223
(CitF) 		5 VAL A 428
LEU A 375
SER A 373
LEU A 372
THR A 430
 None
 1.02A 1kw0A-2hj0A:
undetectable		 1kw0A-2hj0A:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2odl ADHESIN

(Haemophilus
influenzae) 		PF05860
(Haemagg_act) 		5 VAL A 333
LEU A 367
SER A 421
THR A 329
GLU A 357
 None
 1.22A 1kw0A-2odlA:
undetectable		 1kw0A-2odlA:
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.
2qcz OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR YAET

(Escherichia
coli) 		PF07244
(POTRA) 		5 VAL A 258
LEU A 226
SER A 228
LEU A 231
THR A 243
 None
 1.07A 1kw0A-2qczA:
undetectable		 1kw0A-2qczA:
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.
2qzx CANDIDAPEPSIN-5

(Candida
albicans) 		PF00026
(Asp) 		5 VAL A 196
LEU A 216
LEU A 217
SER A 219
LEU A 157
 None
 1.21A 1kw0A-2qzxA:
undetectable		 1kw0A-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.
2r4s ANTIBODY FOR BETA2
ADRENOCEPTOR, HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 VAL H 111
LEU H  83
LEU H 109
THR H  87
GLU H  46
 None
 1.36A 1kw0A-2r4sH:
undetectable		 1kw0A-2r4sH:
22.26
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) 		9 LEU A 294
LEU A 295
LEU A 301
THR A 312
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 ( 4.4A)
HBI  A 500 (-3.2A)
FE  A 501 ( 3.4A)
MTY  A 300 (-3.9A)
None
FE  A 501 (-2.1A)
 0.97A 1kw0A-2tohA:
42.9		 1kw0A-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) 		9 VAL A 291
LEU A 294
LEU A 295
LEU A 301
THR A 312
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 ( 4.4A)
HBI  A 500 (-3.2A)
FE  A 501 ( 3.4A)
None
FE  A 501 (-2.1A)
 0.91A 1kw0A-2tohA:
42.9		 1kw0A-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.
2v28 PHENYLALANINE-4-HYDR
OXYLASE

(Colwellia
psychrerythraea) 		PF00351
(Biopterin_H) 		5 GLU A 123
HIS A 127
TYR A 162
TRP A 163
GLU A 167
 None
 1.22A 1kw0A-2v28A:
26.7		 1kw0A-2v28A:
27.54
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.
2v28 PHENYLALANINE-4-HYDR
OXYLASE

(Colwellia
psychrerythraea) 		PF00351
(Biopterin_H) 		5 VAL A  82
GLU A 123
HIS A 127
TYR A 162
GLU A 167
 None
 1.04A 1kw0A-2v28A:
26.7		 1kw0A-2v28A:
27.54
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.
2vec PIRIN-LIKE PROTEIN
YHAK

(Escherichia
coli) 		PF02678
(Pirin) 		5 VAL A  42
LEU A  93
THR A  23
TYR A  75
GLU A 103
 None
 1.06A 1kw0A-2vecA:
undetectable		 1kw0A-2vecA:
21.05
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.
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)
 1.21A 1kw0A-2vqaA:
undetectable		 1kw0A-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.
3eck PROTEIN
(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 1kw0A-3eckA:
undetectable		 1kw0A-3eckA:
20.20
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.
3efc OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR YAET

(Escherichia
coli) 		PF07244
(POTRA) 		5 VAL A 258
LEU A 226
SER A 228
LEU A 231
THR A 243
 None
 0.83A 1kw0A-3efcA:
undetectable		 1kw0A-3efcA:
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.
3g77 CYTOSINE DEAMINASE

(Escherichia
coli) 		PF07969
(Amidohydro_3) 		6 VAL A 226
LEU A 261
SER A 259
PHE A 262
THR A 247
GLU A 300
 None
 1.50A 1kw0A-3g77A:
undetectable		 1kw0A-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.
3gms PUTATIVE
NADPH:QUINONE
REDUCTASE

(Bacillus
thuringiensis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 VAL A 132
LEU A 238
THR A 129
HIS A 265
TRP A 250
 None
 1.37A 1kw0A-3gmsA:
undetectable		 1kw0A-3gmsA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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 1kw0A-3gz8A:
undetectable		 1kw0A-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.
3hdi PROCESSING PROTEASE

(Bacillus
halodurans) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 LEU A 163
THR A  84
GLU A  49
HIS A  50
GLU A 126
 None
None
CO  A 500 ( 4.3A)
CO  A 500 (-3.4A)
CO  A 500 (-2.1A)
 1.34A 1kw0A-3hdiA:
undetectable		 1kw0A-3hdiA:
20.98
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) 		9 VAL A 232
LEU A 236
PHE A 241
LEU A 242
THR A 253
GLU A 273
HIS A 277
TYR A 312
GLU A 317
 None
None
None
None
None
FE  A 400 ( 4.6A)
FE  A 400 (-3.2A)
None
FE  A 400 ( 1.9A)
 0.95A 1kw0A-3hf8A:
40.6		 1kw0A-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
 0.85A 1kw0A-3ipoA:
undetectable		 1kw0A-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.
3kio RIBONUCLEASE H2
SUBUNIT A

(Mus musculus) 		PF01351
(RNase_HII) 		5 LEU A 101
SER A 103
LEU A 107
THR A 121
TRP A 239
 None
 1.35A 1kw0A-3kioA:
undetectable		 1kw0A-3kioA:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nmz APC VARIANT PROTEIN

(Homo sapiens) 		PF00514
(Arm) 		5 LEU A 508
LEU A 505
LEU A 478
THR A 518
HIS A 361
 None
 1.20A 1kw0A-3nmzA:
undetectable		 1kw0A-3nmzA:
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.
3p5p TAXADIENE SYNTHASE

(Taxus
brevifolia) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 VAL A 145
LEU A 336
LEU A 333
SER A 309
THR A 142
 None
 1.37A 1kw0A-3p5pA:
undetectable		 1kw0A-3p5pA:
19.19
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.
3tts BETA-GALACTOSIDASE

(Bacillus
circulans) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 VAL A 401
LEU A 434
LEU A 610
HIS A 337
GLU A 618
 None
 1.36A 1kw0A-3ttsA:
undetectable		 1kw0A-3ttsA:
20.60
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.
3wa1 BINB PROTEIN

(Lysinibacillus
sphaericus) 		PF05431
(Toxin_10) 		5 VAL A 157
LEU A 188
SER A 184
PHE A 177
THR A 173
 None
 1.13A 1kw0A-3wa1A:
undetectable		 1kw0A-3wa1A:
21.20
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.
4akm LYSOSOME-ASSOCIATED
MEMBRANE
GLYCOPROTEIN 3

(Homo sapiens) 		PF01299
(Lamp) 		5 LEU A 360
SER A 336
PHE A 337
THR A 355
GLU A 375
 None
 1.15A 1kw0A-4akmA:
undetectable		 1kw0A-4akmA:
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.
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 1kw0A-4d9rA:
undetectable		 1kw0A-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.
4ggv CYTOCHROME P450
SUPERFAMILY PROTEIN

(Streptomyces
himastatinicus) 		PF00067
(p450) 		5 VAL A   4
LEU A 280
SER A 281
LEU A 277
THR A   3
 None
 1.34A 1kw0A-4ggvA:
undetectable		 1kw0A-4ggvA:
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.
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
 1.25A 1kw0A-4mtlA:
undetectable		 1kw0A-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.
4nha ENDORIBONUCLEASE
DICER

(Homo sapiens) 		PF02170
(PAZ) 		5 LEU A 848
SER A 845
THR A 983
HIS A1031
TYR A 842
 None
 1.22A 1kw0A-4nhaA:
undetectable		 1kw0A-4nhaA:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pk1 CHIMERA PROTEIN OF
OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTORS BAMA AND
BAMB

(Escherichia
coli) 		PF07244
(POTRA)
PF13360
(PQQ_2) 		5 VAL A 258
LEU A 226
SER A 228
LEU A 231
THR A 243
 None
 1.10A 1kw0A-4pk1A:
undetectable		 1kw0A-4pk1A:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.38A 1kw0A-4q1vA:
undetectable		 1kw0A-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 VAL A 368
LEU A 259
SER A 261
LEU A 380
TRP A 389
 None
 1.31A 1kw0A-4umzA:
undetectable		 1kw0A-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) 		6 VAL A 278
LEU A 282
PHE A 287
LEU A 288
THR A 299
TYR A 358
 None
None
IMD  A 600 ( 4.4A)
None
None
None
 0.96A 1kw0A-4v06A:
41.7		 1kw0A-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
PHE A 287
LEU A 288
THR A 299
GLU A 319
HIS A 323
TYR A 358
 None
IMD  A 600 ( 4.4A)
None
None
IMD  A 600 (-3.3A)
FE  A1491 ( 3.3A)
None
 0.97A 1kw0A-4v06A:
41.7		 1kw0A-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
PHE A 287
THR A 299
GLU A 319
HIS A 323
TYR A 358
GLU A 363
 None
IMD  A 600 ( 4.4A)
None
IMD  A 600 (-3.3A)
FE  A1491 ( 3.3A)
None
FE  A1491 ( 2.0A)
 0.98A 1kw0A-4v06A:
41.7		 1kw0A-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.
4wk0 INTEGRIN BETA-1

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		5 VAL B 238
LEU B 306
LEU B 254
PHE B 256
TYR B 325
 None
 1.17A 1kw0A-4wk0B:
undetectable		 1kw0A-4wk0B:
22.02
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.
4xga OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMA

(Escherichia
coli) 		PF07244
(POTRA) 		5 VAL B 258
LEU B 226
SER B 228
LEU B 231
THR B 243
 None
 0.94A 1kw0A-4xgaB:
undetectable		 1kw0A-4xgaB:
20.94
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.
4zd5 AMSH-LIKE PROTEASE
SST2

(Schizosaccharomyces
pombe) 		PF01398
(JAB) 		5 LEU A 402
SER A 352
LEU A 355
GLU A 286
HIS A 343
 None
ZN  A 502 ( 4.2A)
None
EDO  A 505 (-3.2A)
ZN  A 501 (-3.3A)
 1.36A 1kw0A-4zd5A:
undetectable		 1kw0A-4zd5A:
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.
5aex AMMONIUM TRANSPORTER
MEP2

(Saccharomyces
cerevisiae) 		PF00909
(Ammonium_transp) 		5 LEU A  56
SER A  54
LEU A  51
THR A 289
GLU A 441
 None
 1.25A 1kw0A-5aexA:
undetectable		 1kw0A-5aexA:
19.96
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.
5dfv FAB HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 VAL C 409
LEU C 317
LEU C 407
THR C 321
GLU C 211
 None
 1.29A 1kw0A-5dfvC:
undetectable		 1kw0A-5dfvC:
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.
5f9s SERINE--PYRUVATE
AMINOTRANSFERASE

(Homo sapiens) 		PF00266
(Aminotran_5) 		5 LEU A 153
PHE A 152
LEU A 181
GLU A 157
TYR A 204
 None
 1.37A 1kw0A-5f9sA:
undetectable		 1kw0A-5f9sA:
20.79
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.
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
 1.28A 1kw0A-5j90A:
undetectable		 1kw0A-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)
 1.00A 1kw0A-5jk6A:
41.5		 1kw0A-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) 		10 VAL A 233
LEU A 236
LEU A 237
PHE A 242
LEU A 243
THR A 254
GLU A 274
HIS A 278
TYR A 313
GLU A 318
 None
None
None
None
None
None
None
FE  A 502 (-3.2A)
None
FE  A 502 (-2.1A)
 0.84A 1kw0A-5jk6A:
41.5		 1kw0A-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
PHE A 242
LEU A 243
THR A 254
GLU A 274
HIS A 278
TYR A 313
TRP A 314
GLU A 318
 None
None
None
None
None
FE  A 502 (-3.2A)
None
None
FE  A 502 (-2.1A)
 0.90A 1kw0A-5jk6A:
41.5		 1kw0A-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.
5k1c UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 12

(Homo sapiens) 		PF00443
(UCH) 		5 VAL A 278
LEU A 259
SER A 203
LEU A 202
THR A 210
 None
 1.34A 1kw0A-5k1cA:
undetectable		 1kw0A-5k1cA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kte DIVALENT METAL
CATION TRANSPORTER
MNTH

(Deinococcus
radiodurans) 		PF01566
(Nramp) 		5 VAL A 160
LEU A 325
SER A 323
LEU A 320
THR A 161
 None
 1.32A 1kw0A-5kteA:
undetectable		 1kw0A-5kteA:
20.95
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) 		9 VAL A 232
LEU A 236
PHE A 241
LEU A 242
THR A 253
GLU A 273
HIS A 277
TYR A 312
GLU A 317
 None
None
6Z4  A 502 ( 4.8A)
None
None
FE  A 501 ( 4.8A)
FE  A 501 (-3.3A)
6Z4  A 502 ( 4.6A)
FE  A 501 ( 1.8A)
 0.97A 1kw0A-5l01A:
41.0		 1kw0A-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.
5lnx ACYL-COA
DEHYDROGENASE

(Bacillus
subtilis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 VAL A 332
LEU A 349
LEU A 350
TYR A 203
GLU A  30
 None
 1.36A 1kw0A-5lnxA:
undetectable		 1kw0A-5lnxA:
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.
5myb ANGIOPOIETIN-1
RECEPTOR

(Homo sapiens) 		PF00041
(fn3) 		5 LEU A 601
LEU A 559
SER A 555
LEU A 634
THR A 562
 NAG  A 801 ( 4.0A)
None
None
None
NAG  A 801 (-4.3A)
 1.34A 1kw0A-5mybA:
undetectable		 1kw0A-5mybA:
23.94
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.
5ndf POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 2

(Homo sapiens) 		no annotation 5 VAL A 468
LEU A 497
SER A 489
LEU A 484
THR A 459
 None
 1.22A 1kw0A-5ndfA:
undetectable		 1kw0A-5ndfA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 VAL A4041
SER A4045
PHE A4147
HIS A4054
TYR A4049
 None
 1.35A 1kw0A-5nugA:
undetectable		 1kw0A-5nugA:
5.49
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.
5oon UNDECAPRENYL-DIPHOSP
HATASE

(Escherichia
coli) 		no annotation 5 VAL A 201
LEU A  71
LEU A  68
PHE A  64
GLU A  83
 None
 1.36A 1kw0A-5oonA:
undetectable		 1kw0A-5oonA:
15.52
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.
5utk ANGIOPOIETIN-1
RECEPTOR

(Homo sapiens) 		PF00041
(fn3) 		5 LEU A 601
LEU A 559
SER A 555
LEU A 634
THR A 562
 None
 1.32A 1kw0A-5utkA:
undetectable		 1kw0A-5utkA:
24.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.32A 1kw0A-5v8f7:
undetectable		 1kw0A-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.
5veh KYNURENINE
AMINOTRANSFERASE

(Aedes aegypti) 		no annotation 5 LEU A 274
LEU A 105
LEU A  86
THR A 117
TYR A  90
 None
 1.32A 1kw0A-5vehA:
undetectable		 1kw0A-5vehA:
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.
5w8u ORF1AB PROTEIN

(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
MPD  A 405 ( 4.7A)
None
None
 1.36A 1kw0A-5w8uA:
undetectable		 1kw0A-5w8uA:
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.
5wp0 NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Aliivibrio
fischeri) 		PF02540
(NAD_synthase) 		5 VAL A 201
LEU A 193
LEU A 244
THR A  52
GLU A 171
 None
 1.37A 1kw0A-5wp0A:
undetectable		 1kw0A-5wp0A:
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.
5y50 PROTEIN
DETOXIFICATION 14

(Arabidopsis
thaliana) 		no annotation 5 VAL A 344
LEU A 299
SER A 297
HIS A 386
GLU A 265
 None
 1.08A 1kw0A-5y50A:
undetectable		 1kw0A-5y50A:
16.06
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.
5zal ENDORIBONUCLEASE
DICER

(Homo sapiens) 		no annotation 5 LEU A 858
SER A 855
THR A 993
HIS A1041
TYR A 852
 None
 1.38A 1kw0A-5zalA:
undetectable		 1kw0A-5zalA:
13.56
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.
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
 1.13A 1kw0A-6c1qB:
undetectable		 1kw0A-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.
6ejg SINGLE CHAIN FV
FRAGMENT

(Mus musculus) 		no annotation 5 VAL C 287
LEU C 252
LEU C 285
THR C 256
GLU C 215
 None
 1.30A 1kw0A-6ejgC:
undetectable		 1kw0A-6ejgC:
12.46