SIMILAR PATTERNS OF AMINO ACIDS FOR 2QHF_A_ACTA507_0

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bt2 PROTEIN (CATECHOL
OXIDASE)

(Ipomoea batatas) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		3 LEU A 153
ASN A 158
ARG A 169
 None
 0.86A 2qhfA-1bt2A:
0.0		 2qhfA-1bt2A:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dcf ETR1 PROTEIN

(Arabidopsis
thaliana) 		PF00072
(Response_reg) 		3 LEU A  44
ASN A  40
ARG A  71
 None
 0.94A 2qhfA-1dcfA:
0.0		 2qhfA-1dcfA:
13.33
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.
1e4o MALTODEXTRIN
PHOSPHORYLASE

(Escherichia
coli) 		PF00343
(Phosphorylase) 		3 LEU A  36
ASN A 165
ARG A  32
 None
 0.85A 2qhfA-1e4oA:
0.0		 2qhfA-1e4oA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fw3 OUTER MEMBRANE
PHOSPHOLIPASE A

(Escherichia
coli) 		PF02253
(PLA1) 		3 LEU A  48
ASN A  49
ARG A 110
 None
 0.79A 2qhfA-1fw3A:
0.0		 2qhfA-1fw3A:
20.10
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.
1h1c HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Thermotoga
maritima) 		PF00155
(Aminotran_1_2) 		3 LEU A 328
ASN A 324
ARG A 264
 None
 0.77A 2qhfA-1h1cA:
0.0		 2qhfA-1h1cA:
23.56
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.
1n7u ADSORPTION PROTEIN
P2

(Salmonella
virus PRD1) 		PF09214
(Prd1-P2) 		3 LEU A 392
ASN A  78
ARG A  70
 None
 0.96A 2qhfA-1n7uA:
undetectable		 2qhfA-1n7uA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nex CDC4 PROTEIN

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12937
(F-box-like) 		3 LEU B 362
ASN B 324
ARG B 700
 None
 0.92A 2qhfA-1nexB:
0.0		 2qhfA-1nexB:
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.
1pv5 HYPOTHETICAL PROTEIN
YWQG

(Bacillus
subtilis) 		PF09234
(DUF1963) 		3 LEU A   4
ASN A   2
ARG A  12
 None
 0.97A 2qhfA-1pv5A:
0.0		 2qhfA-1pv5A:
18.25
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.
1qd6 PROTEIN (OUTER
MEMBRANE
PHOSPHOLIPASE
(OMPLA))

(Escherichia
coli) 		PF02253
(PLA1) 		3 LEU C  48
ASN C  49
ARG C 110
 None
 0.83A 2qhfA-1qd6C:
0.0		 2qhfA-1qd6C:
20.39
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.
1qgr PROTEIN (IMPORTIN
BETA SUBUNIT)

(Homo sapiens) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		3 LEU A 192
ASN A 188
ARG A 232
 None
 0.83A 2qhfA-1qgrA:
undetectable		 2qhfA-1qgrA:
20.05
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.
1u2z HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC

(Saccharomyces
cerevisiae) 		PF08123
(DOT1) 		3 LEU A 529
ASN A 527
ARG A 511
 None
 0.93A 2qhfA-1u2zA:
undetectable		 2qhfA-1u2zA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u3d CRYPTOCHROME 1
APOPROTEIN

(Arabidopsis
thaliana) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		3 LEU A 110
ASN A 108
ARG A  19
 None
 0.94A 2qhfA-1u3dA:
undetectable		 2qhfA-1u3dA:
22.98
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.
1uf2 CORE PROTEIN P3

(Rice dwarf
virus) 		PF09231
(RDV-p3) 		3 LEU A 463
ASN A 461
ARG A 431
 None
 0.79A 2qhfA-1uf2A:
undetectable		 2qhfA-1uf2A:
17.80
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.
1vbg PYRUVATE,ORTHOPHOSPH
ATE DIKINASE

(Zea mays) 		PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C) 		3 LEU A 276
ASN A 278
ARG A 289
 None
 0.94A 2qhfA-1vbgA:
undetectable		 2qhfA-1vbgA:
19.42
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.
1wky ENDO-BETA-1,4-MANNAN
ASE

(Bacillus sp.
JAMB-602) 		PF00150
(Cellulase) 		3 LEU A 188
ASN A 186
ARG A 180
 None
 0.77A 2qhfA-1wkyA:
undetectable		 2qhfA-1wkyA:
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.
1xiw T-CELL SURFACE
GLYCOPROTEIN CD3
EPSILON CHAIN
IMMUNOGLOBULIN HEAVY
CHAIN VARIABLE
REGION

(Homo sapiens;
Mus musculus) 		PF16681
(Ig_5)
PF07686
(V-set) 		3 LEU D  50
ASN D  52
ARG A  80
 None
 0.91A 2qhfA-1xiwD:
undetectable		 2qhfA-1xiwD:
14.67
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.
1yzx GLUTATHIONE
S-TRANSFERASE KAPPA
1

(Homo sapiens) 		PF01323
(DSBA) 		3 LEU A 210
ASN A  34
ARG A   6
 None
 0.95A 2qhfA-1yzxA:
undetectable		 2qhfA-1yzxA:
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.
1z2o INOSITOL
1,3,4-TRISPHOSPHATE
5/6-KINASE

(Entamoeba
histolytica) 		PF05770
(Ins134_P3_kin) 		3 LEU X 187
ASN X 185
ARG X 257
 None
 0.94A 2qhfA-1z2oX:
undetectable		 2qhfA-1z2oX:
19.22
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.
2cfa THYMIDYLATE SYNTHASE

(Paramecium
bursaria
Chlorella virus
1) 		PF02511
(Thy1) 		3 LEU B  44
ASN B  38
ARG B  28
 CME  B  48 ( 4.7A)
None
None
 0.84A 2qhfA-2cfaB:
undetectable		 2qhfA-2cfaB:
19.41
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.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		3 LEU A 144
ASN A 141
ARG A 140
 None
 0.91A 2qhfA-2f9qA:
undetectable		 2qhfA-2f9qA:
25.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2g85 CHORISMATE SYNTHASE

(Mycobacterium
tuberculosis) 		PF01264
(Chorismate_synt) 		3 LEU A  15
ASN A  79
ARG A 139
 None
 0.21A 2qhfA-2g85A:
59.1		 2qhfA-2g85A:
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.
2j0r HEMIN TRANSPORT
PROTEIN HEMS

(Yersinia
enterocolitica) 		PF05171
(HemS) 		3 LEU A 105
ASN A  87
ARG A  52
 None
 0.79A 2qhfA-2j0rA:
undetectable		 2qhfA-2j0rA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j66 BTRK

(Bacillus
circulans) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		3 LEU A 377
ASN A  53
ARG A 404
 None
 0.93A 2qhfA-2j66A:
undetectable		 2qhfA-2j66A:
22.91
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.
2jau 5'(3')-DEOXYRIBONUCL
EOTIDASE

(Homo sapiens) 		PF06941
(NT5C) 		3 LEU A  36
ASN A 123
ARG A 226
 None
 0.98A 2qhfA-2jauA:
undetectable		 2qhfA-2jauA:
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.
2mpv MAJOR FIMBRIAL
SUBUNIT OF
AGGREGATIVE
ADHERENCE FIMBRIA II
AAFA

(Escherichia
coli) 		no annotation 3 LEU A  37
ASN A  24
ARG A  25
 None
 0.83A 2qhfA-2mpvA:
undetectable		 2qhfA-2mpvA:
17.70
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.
2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC

(Homo sapiens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		3 LEU A 455
ASN A  66
ARG A 464
 None
 0.90A 2qhfA-2p8uA:
undetectable		 2qhfA-2p8uA:
23.59
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.
2qna IMPORTIN SUBUNIT
BETA-1

(Homo sapiens) 		PF13513
(HEAT_EZ) 		3 LEU A 192
ASN A 188
ARG A 232
 None
 0.88A 2qhfA-2qnaA:
undetectable		 2qhfA-2qnaA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rfr UNCHARACTERIZED
PROTEIN

(Novosphingobium
aromaticivorans) 		PF13577
(SnoaL_4) 		3 LEU A 140
ASN A 138
ARG A 116
 None
 0.87A 2qhfA-2rfrA:
undetectable		 2qhfA-2rfrA:
21.33
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.
2spt PROTHROMBIN

(Bos taurus) 		PF00051
(Kringle)
PF00594
(Gla) 		3 LEU A  58
ASN A  53
ARG A  52
 None
 0.72A 2qhfA-2sptA:
undetectable		 2qhfA-2sptA:
18.06
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.
2vnu EXOSOME COMPLEX
EXONUCLEASE RRP44

(Saccharomyces
cerevisiae) 		PF00773
(RNB)
PF17215
(Rrp44_S1)
PF17216
(Rrp44_CSD1) 		3 LEU D 790
ASN D 695
ARG D 806
 None
 0.98A 2qhfA-2vnuD:
undetectable		 2qhfA-2vnuD:
20.89
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.
2vsq SURFACTIN SYNTHETASE
SUBUNIT 3

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		3 LEU A 683
ASN A 655
ARG A 523
 None
 0.71A 2qhfA-2vsqA:
undetectable		 2qhfA-2vsqA:
14.79
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.
2wya HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		3 LEU A 492
ASN A 103
ARG A 501
 None
 0.84A 2qhfA-2wyaA:
undetectable		 2qhfA-2wyaA:
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.
2wz8 CELLULOSOME PROTEIN
DOCKERIN TYPE I

(Ruminiclostridium
thermocellum) 		PF03422
(CBM_6) 		3 LEU A  20
ASN A  18
ARG A  26
 None
 0.75A 2qhfA-2wz8A:
undetectable		 2qhfA-2wz8A:
17.16
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.
2x8r GLYCOSYL HYDROLASE

(Aspergillus
fumigatus) 		PF01183
(Glyco_hydro_25) 		3 LEU A  65
ASN A  97
ARG A 213
 None
 0.72A 2qhfA-2x8rA:
undetectable		 2qhfA-2x8rA:
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.
2zwr METALLO-BETA-LACTAMA
SE SUPERFAMILY
PROTEIN

(Thermus
thermophilus) 		PF00753
(Lactamase_B) 		3 LEU A 192
ASN A 197
ARG A 148
 None
 0.96A 2qhfA-2zwrA:
undetectable		 2qhfA-2zwrA:
18.36
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.
3asi NEUREXIN-1-ALPHA

(Bos taurus) 		PF02210
(Laminin_G_2) 		3 LEU A 931
ASN A 982
ARG A 958
 None
 0.81A 2qhfA-3asiA:
undetectable		 2qhfA-3asiA:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN

(Mesorhizobium
loti) 		PF01633
(Choline_kinase) 		3 LEU A 172
ASN A 202
ARG A 126
 None
 0.98A 2qhfA-3dxqA:
undetectable		 2qhfA-3dxqA:
22.63
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.
3e9z PURINE-NUCLEOSIDE
PHOSPHORYLASE

(Schistosoma
mansoni) 		PF01048
(PNP_UDP_1) 		3 LEU A 212
ASN A 123
ARG A 124
 None
 0.93A 2qhfA-3e9zA:
undetectable		 2qhfA-3e9zA:
20.62
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.
3eye PTS SYSTEM
N-ACETYLGALACTOSAMIN
E-SPECIFIC IIB
COMPONENT 1

(Escherichia
coli) 		PF03830
(PTSIIB_sorb) 		3 LEU A  15
ASN A  13
ARG A  87
 None
 0.85A 2qhfA-3eyeA:
undetectable		 2qhfA-3eyeA:
18.18
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.
3f41 PHYTASE

(Mitsuokella
multacida) 		PF14566
(PTPlike_phytase) 		3 LEU A 582
ASN A 368
ARG A 390
 None
 0.96A 2qhfA-3f41A:
undetectable		 2qhfA-3f41A:
22.57
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.
3g4f (+)-DELTA-CADINENE
SYNTHASE ISOZYME XC1

(Gossypium
arboreum) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 LEU A 503
ASN A 499
ARG A 122
 None
 0.60A 2qhfA-3g4fA:
undetectable		 2qhfA-3g4fA:
21.13
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.
3lkd TYPE I
RESTRICTION-MODIFICA
TION SYSTEM
METHYLTRANSFERASE
SUBUNIT

(Streptococcus
thermophilus) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		3 LEU A 456
ASN A 411
ARG A 447
 None
 0.93A 2qhfA-3lkdA:
undetectable		 2qhfA-3lkdA:
22.32
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.
3mbf FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Encephalitozoon
cuniculi) 		PF00274
(Glycolytic) 		3 LEU A 245
ASN A 279
ARG A 285
 None
 0.84A 2qhfA-3mbfA:
undetectable		 2qhfA-3mbfA:
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.
3n0g ISOPRENE SYNTHASE

(Populus tremula
x Populus alba) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 LEU A 541
ASN A 537
ARG A 159
 None
 0.76A 2qhfA-3n0gA:
undetectable		 2qhfA-3n0gA:
23.25
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.
3n6u LYSR TYPE REGULATOR
OF TSAMBCD

(Comamonas
testosteroni) 		PF03466
(LysR_substrate) 		3 LEU A 142
ASN A 124
ARG A 126
 None
 0.98A 2qhfA-3n6uA:
undetectable		 2qhfA-3n6uA:
21.52
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.
3o01 CELL INVASION
PROTEIN SIPD

(Salmonella
enterica) 		PF06511
(IpaD) 		3 LEU A 245
ASN A 242
ARG A 232
 None
 0.92A 2qhfA-3o01A:
undetectable		 2qhfA-3o01A:
22.36
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.
3o0y LIPOPROTEIN

(Colwellia
psychrerythraea) 		PF05960
(DUF885) 		3 LEU A 194
ASN A 192
ARG A 273
 None
 0.92A 2qhfA-3o0yA:
undetectable		 2qhfA-3o0yA:
21.52
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.
3o8l 6-PHOSPHOFRUCTOKINAS
E, MUSCLE TYPE

(Oryctolagus
cuniculus) 		PF00365
(PFK) 		3 LEU A 434
ASN A 489
ARG A 432
 None
 0.95A 2qhfA-3o8lA:
undetectable		 2qhfA-3o8lA:
21.24
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.
3p1t PUTATIVE
HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Burkholderia
pseudomallei) 		PF00155
(Aminotran_1_2) 		3 LEU A 326
ASN A 322
ARG A 259
 None
 0.86A 2qhfA-3p1tA:
undetectable		 2qhfA-3p1tA:
22.54
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.
3q5i PROTEIN KINASE

(Plasmodium
berghei) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		3 LEU A 204
ASN A 202
ARG A 159
 None
 0.86A 2qhfA-3q5iA:
undetectable		 2qhfA-3q5iA:
20.72
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.
3qn3 ENOLASE

(Campylobacter
jejuni) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 LEU A 270
ASN A 214
ARG A 266
 None
 0.76A 2qhfA-3qn3A:
undetectable		 2qhfA-3qn3A:
22.94
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.
3qu1 PEPTIDE DEFORMYLASE
2

(Vibrio cholerae) 		PF01327
(Pep_deformylase) 		3 LEU A 142
ASN A 141
ARG A  15
 None
None
CL  A 508 (-4.6A)
 0.93A 2qhfA-3qu1A:
undetectable		 2qhfA-3qu1A:
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.
4b3i FATTY ACID
BETA-OXIDATION
COMPLEX BETA-CHAIN
FADA

(Mycobacterium
tuberculosis) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		3 LEU C 323
ASN C 351
ARG C 379
 None
 0.81A 2qhfA-4b3iC:
undetectable		 2qhfA-4b3iC:
24.46
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.
4c2k 3-KETOACYL-COA
THIOLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		3 LEU A 316
ASN A 344
ARG A 372
 None
None
DTT  A1400 (-3.6A)
 0.83A 2qhfA-4c2kA:
undetectable		 2qhfA-4c2kA:
23.96
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.
4chm IMC SUB-COMPARTMENT
PROTEIN ISP1

(Toxoplasma
gondii) 		no annotation 3 LEU A  81
ASN A 135
ARG A 157
 None
None
SO4  A1182 (-3.0A)
 0.78A 2qhfA-4chmA:
undetectable		 2qhfA-4chmA:
16.98
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.
4d1d HYDANTOIN TRANSPORT
PROTEIN

(Microbacterium
liquefaciens) 		PF02133
(Transp_cyt_pur) 		3 LEU A 466
ASN A 462
ARG A  85
 None
 0.89A 2qhfA-4d1dA:
undetectable		 2qhfA-4d1dA:
24.51
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.
4di5 5-EPI-ARISTOLOCHENE
SYNTHASE

(Nicotiana
tabacum) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 LEU A 496
ASN A 492
ARG A 115
 None
ACT  A 601 (-4.0A)
None
 0.86A 2qhfA-4di5A:
undetectable		 2qhfA-4di5A:
21.52
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.
4dte SERPIN PEPTIDASE
INHIBITOR, CLADE E
(NEXIN, PLASMINOGEN
ACTIVATOR INHIBITOR
TYPE 1), MEMBER 1

(Danio rerio) 		PF00079
(Serpin) 		3 LEU A 228
ASN A 201
ARG A 255
 None
 0.87A 2qhfA-4dteA:
undetectable		 2qhfA-4dteA:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dup QUINONE
OXIDOREDUCTASE

(Rhizobium etli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 LEU A  69
ASN A  96
ARG A 271
 None
 0.93A 2qhfA-4dupA:
undetectable		 2qhfA-4dupA:
23.04
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.
4dza LYSINE RACEMASE

(Proteus
mirabilis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 LEU A 105
ASN A 101
ARG A 119
 None
 0.58A 2qhfA-4dzaA:
undetectable		 2qhfA-4dzaA:
24.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gax AMORPHA-4,11-DIENE
SYNTHASE

(Artemisia annua) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 LEU A 495
ASN A 491
ARG A 111
 None
 0.78A 2qhfA-4gaxA:
undetectable		 2qhfA-4gaxA:
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.
4jgi PUTATIVE
UNCHARACTERIZED
PROTEIN

(Desulfitobacterium
hafniense) 		PF02310
(B12-binding)
PF02607
(B12-binding_2) 		3 LEU A 173
ASN A 171
ARG A 170
 None
 0.72A 2qhfA-4jgiA:
undetectable		 2qhfA-4jgiA:
19.56
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.
4mzv EPITHELIAL CELL
ADHESION MOLECULE

(Homo sapiens) 		PF00086
(Thyroglobulin_1) 		3 LEU A 264
ASN A  91
ARG A 125
 None
 0.92A 2qhfA-4mzvA:
undetectable		 2qhfA-4mzvA:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n0f IGG RECEPTOR FCRN
LARGE SUBUNIT P51

(Homo sapiens) 		PF00129
(MHC_I)
PF07654
(C1-set) 		3 LEU A  98
ASN A 102
ARG A 164
 None
 0.64A 2qhfA-4n0fA:
undetectable		 2qhfA-4n0fA:
21.03
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.
4ph0 BLV CAPSID

(Bovine leukemia
virus) 		PF00607
(Gag_p24) 		3 LEU A 118
ASN A 115
ARG A  41
 None
 0.85A 2qhfA-4ph0A:
undetectable		 2qhfA-4ph0A:
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.
4pzv 2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE/DI
HYDROPTEROATE
SYNTHASE

(Francisella
tularensis) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		3 LEU A 157
ASN A 125
ARG A 153
 None
 0.89A 2qhfA-4pzvA:
undetectable		 2qhfA-4pzvA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q8h PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Saccharomyces
cerevisiae) 		PF00929
(RNase_T)
PF13423
(UCH_1) 		3 LEU A1004
ASN A 871
ARG A1000
 None
 0.85A 2qhfA-4q8hA:
undetectable		 2qhfA-4q8hA:
19.13
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		3 LEU A3263
ASN A3391
ARG A3222
 None
 0.94A 2qhfA-4rh7A:
undetectable		 2qhfA-4rh7A:
8.43
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.
4roa SERPIN 2

(Anopheles
gambiae) 		PF00079
(Serpin) 		3 LEU A 262
ASN A 381
ARG A 384
 None
 0.76A 2qhfA-4roaA:
undetectable		 2qhfA-4roaA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4sli INTRAMOLECULAR
TRANS-SIALIDASE

(Macrobdella
decora) 		PF02973
(Sialidase)
PF13088
(BNR_2) 		3 LEU A 739
ASN A 364
ARG A 736
 None
 0.99A 2qhfA-4sliA:
undetectable		 2qhfA-4sliA:
19.56
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.
4x6k ANHYDROSIALIDASE

([Ruminococcus]
gnavus) 		PF13088
(BNR_2) 		3 LEU A 703
ASN A 328
ARG A 700
 None
 0.88A 2qhfA-4x6kA:
undetectable		 2qhfA-4x6kA:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xhf NA-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT C
NQRC

(Shewanella
oneidensis) 		PF04205
(FMN_bind) 		3 LEU A  78
ASN A 119
ARG A 117
 None
 0.97A 2qhfA-4xhfA:
undetectable		 2qhfA-4xhfA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xr7 PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Saccharomyces
cerevisiae) 		no annotation 3 LEU G1004
ASN G 871
ARG G1000
 None
 0.89A 2qhfA-4xr7G:
undetectable		 2qhfA-4xr7G:
19.79
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.
4y25 POLY-BETA-1,6-N-ACET
YL-D-GLUCOSAMINE
EXPORT PROTEIN

(Escherichia
coli) 		no annotation 3 LEU A 517
ASN A 516
ARG A 806
 None
 0.90A 2qhfA-4y25A:
undetectable		 2qhfA-4y25A:
23.17
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.
5a98 POLYHEDRIN

(Cypovirus 15) 		no annotation 3 LEU A  29
ASN A 116
ARG A 191
 None
ATP  A 252 ( 4.5A)
None
 0.74A 2qhfA-5a98A:
undetectable		 2qhfA-5a98A:
20.19
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.
5bv9 CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Bacillus
pumilus) 		PF02011
(Glyco_hydro_48) 		3 LEU A 455
ASN A 452
ARG A 565
 None
 0.88A 2qhfA-5bv9A:
undetectable		 2qhfA-5bv9A:
22.16
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.
5cer BD0816

(Bdellovibrio
bacteriovorus) 		PF02113
(Peptidase_S13) 		3 LEU A 415
ASN A 107
ARG A 185
 None
 0.84A 2qhfA-5cerA:
undetectable		 2qhfA-5cerA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5exe OXALATE
OXIDOREDUCTASE
SUBUNIT DELTA

(Moorella
thermoacetica) 		PF00037
(Fer4)
PF01558
(POR) 		3 LEU B  95
ASN B 248
ARG B  20
 None
 0.93A 2qhfA-5exeB:
undetectable		 2qhfA-5exeB:
20.72
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.
5fgu GREEN FLUORESCENT
PROTEIN,EXTRACELLULA
R STREPTODORNASE D

(Streptococcus
pyogenes;
Aequorea
victoria) 		PF01353
(GFP)
PF13930
(Endonuclea_NS_2) 		3 LEU A1173
ASN A1215
ARG A1179
 None
SO4  A1401 (-3.9A)
SO4  A1401 (-4.0A)
 0.84A 2qhfA-5fguA:
undetectable		 2qhfA-5fguA:
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.
5hg0 PANTOTHENATE
SYNTHETASE

(Francisella
tularensis) 		PF02569
(Pantoate_ligase) 		3 LEU A  17
ASN A  15
ARG A  14
 None
 0.86A 2qhfA-5hg0A:
undetectable		 2qhfA-5hg0A:
20.21
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.
5id6 CPF1

(Lachnospiraceae
bacterium
ND2006) 		no annotation 3 LEU A1091
ASN A1070
ARG A1071
 None
 0.92A 2qhfA-5id6A:
undetectable		 2qhfA-5id6A:
13.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jb1 MAJOR CAPSID PROTEIN
L1

(Alphapapillomavirus
7) 		PF00500
(Late_protein_L1) 		3 LEU A 384
ASN A  94
ARG A  97
 None
 0.86A 2qhfA-5jb1A:
undetectable		 2qhfA-5jb1A:
20.08
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.
5jo7 VETISPIRADIENE
SYNTHASE 1

(Hyoscyamus
muticus) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 LEU A 503
ASN A 499
ARG A 123
 None
 0.56A 2qhfA-5jo7A:
undetectable		 2qhfA-5jo7A:
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.
5l2p ARYLESTERASE

(Sulfolobus
solfataricus) 		PF07859
(Abhydrolase_3) 		3 LEU A 208
ASN A 207
ARG A 199
 None
 0.97A 2qhfA-5l2pA:
undetectable		 2qhfA-5l2pA:
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.
5lj6 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB

(Aggregatibacter
actinomycetemcomitans) 		no annotation 3 LEU A 174
ASN A 181
ARG A 151
 None
 0.84A 2qhfA-5lj6A:
undetectable		 2qhfA-5lj6A:
21.41
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.
5lx0 DIPEPTIDASE

(Aspergillus
fumigatus) 		PF01244
(Peptidase_M19) 		3 LEU A 350
ASN A 193
ARG A 217
 None
 0.84A 2qhfA-5lx0A:
undetectable		 2qhfA-5lx0A:
23.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m2n ELONGATOR COMPLEX
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 LEU A 240
ASN A 238
ARG A 268
 None
 0.89A 2qhfA-5m2nA:
undetectable		 2qhfA-5m2nA:
18.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nit GLUCOSE OXIDASE

(Aspergillus
niger) 		no annotation 3 LEU A 373
ASN A 370
ARG A 400
 None
 0.94A 2qhfA-5nitA:
undetectable		 2qhfA-5nitA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nqf APICAL MEMBRANE
ANTIGEN 1

(Plasmodium
falciparum) 		PF02430
(AMA-1) 		3 LEU A 216
ASN A 210
ARG A 199
 LEU  A 216 ( 0.6A)
ASN  A 210 ( 0.6A)
ARG  A 199 ( 0.6A)
 0.87A 2qhfA-5nqfA:
undetectable		 2qhfA-5nqfA:
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.
5vhv ALKYLPURINE DNA
GLYCOSYLASE ALKC

(Pseudomonas
fluorescens) 		no annotation 3 LEU A  45
ASN A  14
ARG A  53
 None
 0.79A 2qhfA-5vhvA:
undetectable		 2qhfA-5vhvA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wai POLYCOMB PROTEIN
SUZ12

(Homo sapiens) 		no annotation 3 LEU B 455
ASN B 456
ARG B 121
 None
 0.79A 2qhfA-5waiB:
undetectable		 2qhfA-5waiB:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wgx FLAVIN-DEPENDENT
HALOGENASE

(Malbranchea
aurantiaca) 		PF04820
(Trp_halogenase) 		3 LEU A  34
ASN A  25
ARG A 166
 None
 0.87A 2qhfA-5wgxA:
0.3		 2qhfA-5wgxA:
20.47
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.
5yxg PILUS ASSEMBLY
PROTEIN

(Lactobacillus
rhamnosus) 		no annotation 3 LEU A 297
ASN A 236
ARG A 306
 None
 0.94A 2qhfA-5yxgA:
undetectable		 2qhfA-5yxgA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yz0 SERINE/THREONINE-PRO
TEIN KINASE ATR

(Homo sapiens) 		no annotation 3 LEU A1901
ASN A1946
ARG A1905
 None
 0.93A 2qhfA-5yz0A:
undetectable		 2qhfA-5yz0A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bzh PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX58

(Mus musculus) 		no annotation 3 LEU A 124
ASN A 121
ARG A 140
 None
 0.88A 2qhfA-6bzhA:
undetectable		 2qhfA-6bzhA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d1w POLYCYSTIN-2

(Homo sapiens) 		no annotation 3 LEU A 374
ASN A 547
ARG A 320
 NAG  A 803 (-4.1A)
None
NAG  A 803 ( 4.3A)
 0.91A 2qhfA-6d1wA:
undetectable		 2qhfA-6d1wA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dfu TRYPTOPHAN--TRNA
LIGASE

(Haemophilus
influenzae) 		no annotation 3 LEU A 302
ASN A 297
ARG A 296
 None
 0.93A 2qhfA-6dfuA:
undetectable		 2qhfA-6dfuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6eoj PROTEIN CFT1

(Saccharomyces
cerevisiae) 		no annotation 3 LEU A 505
ASN A 507
ARG A  33
 None
 0.94A 2qhfA-6eojA:
undetectable		 2qhfA-6eojA:
14.34
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.
6eua ANGIOPOIETIN-RELATED
PROTEIN 3

(Homo sapiens) 		no annotation 3 LEU A 432
ASN A 414
ARG A 288
 None
 0.94A 2qhfA-6euaA:
undetectable		 2qhfA-6euaA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fi2 VEXL

(Achromobacter
denitrificans) 		no annotation 3 LEU A 247
ASN A 272
ARG A 379
 None
 0.89A 2qhfA-6fi2A:
undetectable		 2qhfA-6fi2A:
undetectable