SIMILAR PATTERNS OF AMINO ACIDS FOR 4QZU_C_ACTC202

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.
1bpl ALPHA-1,4-GLUCAN-4-G
LUCANOHYDROLASE
ALPHA-1,4-GLUCAN-4-G
LUCANOHYDROLASE

(Bacillus
licheniformis;
Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 GLU A  12
THR B 369
GLN B 330
TRP A  13
 None
 1.47A 4qzuC-1bplA:
undetectable		 4qzuC-1bplA:
24.62
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.
1dj0 PSEUDOURIDINE
SYNTHASE I

(Escherichia
coli) 		PF01416
(PseudoU_synth_1) 		4 GLU A  40
THR A  52
GLN A  36
TRP A  26
 None
 1.38A 4qzuC-1dj0A:
undetectable		 4qzuC-1dj0A:
19.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ftp MUSCLE FATTY ACID
BINDING PROTEIN

(Schistocerca
gregaria) 		PF00061
(Lipocalin) 		4 TYR A  20
GLU A  74
THR A  76
GLN A  98
 None
 0.95A 4qzuC-1ftpA:
19.2		 4qzuC-1ftpA:
33.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ggl PROTEIN (CELLULAR
RETINOL-BINDING
PROTEIN III)

(Homo sapiens) 		PF00061
(Lipocalin) 		5 TYR A  19
GLU A  72
GLN A  97
TRP A 106
LEU A 119
 None
 0.44A 4qzuC-1gglA:
23.6		 4qzuC-1gglA:
50.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jjx BRAIN-TYPE FATTY
ACID BINDING PROTEIN

(Homo sapiens) 		PF00061
(Lipocalin) 		5 TYR A  19
GLU A  72
THR A  74
GLN A  95
LEU A 117
 None
 0.87A 4qzuC-1jjxA:
18.4		 4qzuC-1jjxA:
36.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kqx CELLULAR
RETINOL-BINDING
PROTEIN

(Danio rerio) 		PF00061
(Lipocalin) 		4 GLU A  72
THR A  74
GLN A  97
TRP A 106
 None
 0.35A 4qzuC-1kqxA:
25.8		 4qzuC-1kqxA:
75.19
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.
1krm ADENOSINE DEAMINASE

(Bos taurus) 		PF00962
(A_deaminase) 		4 TYR A 287
GLU A 317
THR A 315
LEU A 322
 None
 1.42A 4qzuC-1krmA:
undetectable		 4qzuC-1krmA:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lpj RETINOL-BINDING
PROTEIN IV, CELLULAR

(Homo sapiens) 		PF00061
(Lipocalin) 		4 TYR A  19
GLU A  72
GLN A  97
TRP A 106
 None
 0.30A 4qzuC-1lpjA:
25.4		 4qzuC-1lpjA:
58.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nxz HYPOTHETICAL PROTEIN
HI0303

(Haemophilus
influenzae) 		PF04452
(Methyltrans_RNA) 		4 GLU A  90
THR A 225
GLN A  84
LEU A 193
 None
 1.47A 4qzuC-1nxzA:
undetectable		 4qzuC-1nxzA:
17.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o5t TRYPTOPHANYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		4 TYR A 159
GLU A 199
THR A 196
GLN A 284
 None
 1.25A 4qzuC-1o5tA:
undetectable		 4qzuC-1o5tA:
15.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pmp P2 MYELIN PROTEIN

(Bos taurus) 		PF00061
(Lipocalin) 		4 TYR A  19
GLU A  72
THR A  74
GLN A  95
 None
 0.72A 4qzuC-1pmpA:
20.5		 4qzuC-1pmpA:
34.59
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.
1qe0 HISTIDINE--TRNA
LIGASE

(Staphylococcus
aureus) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		4 TYR A 261
GLU A  80
THR A  82
LEU A 259
 None
 1.50A 4qzuC-1qe0A:
undetectable		 4qzuC-1qe0A:
15.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tow FATTY ACID-BINDING
PROTEIN, ADIPOCYTE

(Homo sapiens) 		PF00061
(Lipocalin) 		4 TYR A  19
GLU A  72
THR A  74
GLN A  95
 None
 0.73A 4qzuC-1towA:
21.0		 4qzuC-1towA:
37.59
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.
1vaj HYPOTHETICAL PROTEIN
PH0010

(Pyrococcus
horikoshii) 		PF01871
(AMMECR1) 		4 GLU A 107
THR A  50
GLN A 149
LEU A 111
 None
 1.24A 4qzuC-1vajA:
undetectable		 4qzuC-1vajA:
21.18
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.
1vdh MUCONOLACTONE
ISOMERASE-LIKE
PROTEIN

(Thermus
thermophilus) 		PF06778
(Chlor_dismutase) 		4 GLU A 113
THR A  11
GLN A 191
LEU A 193
 None
 1.41A 4qzuC-1vdhA:
undetectable		 4qzuC-1vdhA:
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.
1vfg POLY A POLYMERASE

(Aquifex
aeolicus) 		PF01743
(PolyA_pol) 		4 TYR A 341
GLU A 252
THR A 322
LEU A 345
 None
 1.30A 4qzuC-1vfgA:
undetectable		 4qzuC-1vfgA:
14.55
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.
1wpx CARBOXYPEPTIDASE Y
INHIBITOR

(Saccharomyces
cerevisiae) 		PF01161
(PBP) 		4 TYR B 668
GLU B 608
THR B 594
LEU B 708
 None
 1.30A 4qzuC-1wpxB:
undetectable		 4qzuC-1wpxB:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xa6 BETA2-CHIMAERIN

(Homo sapiens) 		PF00017
(SH2)
PF00130
(C1_1)
PF00620
(RhoGAP) 		4 TYR A 103
GLU A 135
THR A 131
LEU A 101
 None
 1.34A 4qzuC-1xa6A:
undetectable		 4qzuC-1xa6A:
13.70
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.
2asr ASPARTATE RECEPTOR

(Escherichia
coli) 		PF02203
(TarH) 		4 GLU A 136
THR A 132
GLN A 152
LEU A  67
 None
 1.40A 4qzuC-2asrA:
undetectable		 4qzuC-2asrA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bf4 NADPH-CYTOCHROME
P450 REDUCTASE

(Saccharomyces
cerevisiae) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		4 TYR A 503
GLU A 361
THR A 363
LEU A 481
 None
FAD  A 750 ( 4.9A)
FAD  A 750 ( 4.5A)
None
 1.44A 4qzuC-2bf4A:
undetectable		 4qzuC-2bf4A:
11.84
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.
2btv PROTEIN (VP3 CORE
PROTEIN)

(Bluetongue
virus) 		PF01700
(Orbi_VP3) 		4 TYR A 250
GLU A 600
TRP A 238
LEU A 239
 None
 1.34A 4qzuC-2btvA:
undetectable		 4qzuC-2btvA:
9.69
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.
2gl5 PUTATIVE DEHYDRATASE
PROTEIN

(Salmonella
enterica) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A 277
GLU A 249
THR A 272
LEU A 300
 None
 1.42A 4qzuC-2gl5A:
undetectable		 4qzuC-2gl5A:
14.89
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.
2gn1 THREONINE
DEHYDRATASE
CATABOLIC

(Salmonella
enterica) 		PF00291
(PALP) 		4 GLU A  49
THR A  28
GLN A  52
LEU A  21
 None
 1.37A 4qzuC-2gn1A:
undetectable		 4qzuC-2gn1A:
16.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j3z C2 TOXIN COMPONENT I

(Clostridium
botulinum) 		PF03496
(ADPrib_exo_Tox) 		4 TYR A 141
THR A 337
GLN A 135
LEU A 109
 None
 1.44A 4qzuC-2j3zA:
undetectable		 4qzuC-2j3zA:
15.08
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.
2jbw 2,6-DIHYDROXY-PSEUDO
-OXYNICOTINE
HYDROLASE

(Paenarthrobacter
nicotinovorans) 		PF06500
(DUF1100) 		4 GLU A 153
THR A 150
GLN A  80
LEU A  85
 None
 1.21A 4qzuC-2jbwA:
undetectable		 4qzuC-2jbwA:
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.
2l7b APOLIPOPROTEIN E

(Homo sapiens) 		PF01442
(Apolipoprotein) 		4 GLU A  59
GLN A  55
TRP A 210
LEU A 214
 None
 1.45A 4qzuC-2l7bA:
undetectable		 4qzuC-2l7bA:
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.
2n80 RHO GDP-DISSOCIATION
INHIBITOR 1

(Homo sapiens) 		PF02115
(Rho_GDI) 		4 GLU B 163
THR B 160
GLN B 130
LEU B  75
 None
 1.19A 4qzuC-2n80B:
undetectable		 4qzuC-2n80B:
19.54
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.
2oaj PROTEIN SNI1

(Saccharomyces
cerevisiae) 		PF08596
(Lgl_C) 		4 TYR A 717
GLU A 713
THR A 709
LEU A 731
 None
 1.47A 4qzuC-2oajA:
undetectable		 4qzuC-2oajA:
9.71
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.
2q66 POLY(A) POLYMERASE

(Saccharomyces
cerevisiae) 		PF01909
(NTP_transf_2)
PF04926
(PAP_RNA-bind)
PF04928
(PAP_central) 		4 TYR A 413
GLU A 363
THR A 463
LEU A 437
 None
 1.38A 4qzuC-2q66A:
undetectable		 4qzuC-2q66A:
12.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q9s FATTY ACID-BINDING
PROTEIN

(Mus musculus) 		PF00061
(Lipocalin) 		4 TYR A  19
GLU A  72
THR A  74
GLN A  95
 None
 0.81A 4qzuC-2q9sA:
20.6		 4qzuC-2q9sA:
34.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2rcq RETINOL-BINDING
PROTEIN II, CELLULAR

(Homo sapiens) 		PF00061
(Lipocalin) 		6 TYR A  19
GLU A  72
THR A  74
GLN A  97
TRP A 106
LEU A 119
 None
 0.20A 4qzuC-2rcqA:
26.6		 4qzuC-2rcqA:
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.
2wfx HEDGEHOG-INTERACTING
PROTEIN

(Homo sapiens) 		PF07995
(GSDH) 		4 TYR B 509
THR B 442
GLN B 523
LEU B 451
 None
 1.50A 4qzuC-2wfxB:
undetectable		 4qzuC-2wfxB:
15.02
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.
2wnb -

(Sus scrofa) 		PF00777
(Glyco_transf_29) 		4 TYR A 101
GLU A 218
THR A 119
LEU A 105
 None
 1.44A 4qzuC-2wnbA:
undetectable		 4qzuC-2wnbA:
17.45
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.
3gzs UNCHARACTERIZED SUSD
SUPERFAMILY PROTEIN

(Bacteroides
fragilis) 		PF12741
(SusD-like) 		4 TYR A 191
GLU A 468
THR A 467
LEU A 241
 None
 1.24A 4qzuC-3gzsA:
undetectable		 4qzuC-3gzsA:
12.82
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.
3ics COENZYME A-DISULFIDE
REDUCTASE

(Bacillus
anthracis) 		PF00581
(Rhodanese)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 GLU A 347
GLN A 458
TRP A 459
LEU A 543
 None
 0.85A 4qzuC-3icsA:
undetectable		 4qzuC-3icsA:
13.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ist GLUTAMATE RACEMASE

(Listeria
monocytogenes) 		PF01177
(Asp_Glu_race) 		4 TYR A  32
GLU A 151
THR A  36
LEU A  15
 None
 1.43A 4qzuC-3istA:
undetectable		 4qzuC-3istA:
21.57
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.
3lss SERYL-TRNA
SYNTHETASE

(Trypanosoma
brucei) 		PF00587
(tRNA-synt_2b)
PF02403
(Seryl_tRNA_N) 		4 TYR A 222
GLU A 343
THR A 339
LEU A 217
 None
 1.30A 4qzuC-3lssA:
undetectable		 4qzuC-3lssA:
13.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3nr3 PMP2 PROTEIN

(Homo sapiens) 		PF00061
(Lipocalin) 		4 TYR A  20
GLU A  73
THR A  75
GLN A  96
 None
 0.77A 4qzuC-3nr3A:
20.5		 4qzuC-3nr3A:
31.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pp6 SODIUM-CALCIUM
EXCHANGER

(Doryteuthis
pealeii) 		PF00061
(Lipocalin) 		5 TYR A  20
GLU A  73
THR A  75
GLN A  96
LEU A 117
 None
 0.58A 4qzuC-3pp6A:
21.7		 4qzuC-3pp6A:
36.84
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.
3qpf PUTATIVE
UNCHARACTERIZED
PROTEIN

(Streptococcus
pneumoniae) 		PF06824
(Glyco_hydro_125) 		4 GLU A 152
THR A 150
GLN A 155
LEU A 247
 None
 1.46A 4qzuC-3qpfA:
undetectable		 4qzuC-3qpfA:
14.89
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.
3r5t FERRIC VIBRIOBACTIN
ABC TRANSPORTER,
PERIPLASMIC FERRIC
VIBRIOBACTIN-BINDING
PROTEIN

(Vibrio cholerae) 		PF01497
(Peripla_BP_2) 		4 GLU A 176
THR A 179
GLN A 152
LEU A 300
 None
 1.13A 4qzuC-3r5tA:
undetectable		 4qzuC-3r5tA:
15.72
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.
3vkw REPLICASE LARGE
SUBUNIT

(Tobacco mosaic
virus) 		PF01443
(Viral_helicase1) 		4 GLU A1041
THR A1038
GLN A1022
LEU A1029
 SO4  A1204 (-4.3A)
SO4  A1204 (-3.3A)
SO4  A1204 (-3.8A)
None
 1.40A 4qzuC-3vkwA:
undetectable		 4qzuC-3vkwA:
14.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wbg FATTY ACID-BINDING
PROTEIN, HEART

(Homo sapiens) 		PF00061
(Lipocalin) 		5 TYR A  19
GLU A  72
THR A  74
GLN A  95
LEU A 117
 2AN  A 201 (-4.8A)
None
None
None
None
 0.69A 4qzuC-3wbgA:
21.0		 4qzuC-3wbgA:
37.18
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.
3wiq KOJIBIOSE
PHOSPHORYLASE

(Caldicellulosiruptor
saccharolyticus) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		4 TYR A 337
GLU A 421
THR A 417
TRP A 343
 GLC  A 801 ( 4.0A)
None
BGC  A 802 (-3.0A)
GLC  A 801 (-4.4A)
 1.46A 4qzuC-3wiqA:
undetectable		 4qzuC-3wiqA:
11.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zxu MCM21
CTF19

(Kluyveromyces
lactis;
Kluyveromyces
lactis) 		PF09496
(CENP-O)
no annotation 		4 GLU A 144
THR B 175
GLN A 217
LEU A 210
 None
 1.41A 4qzuC-3zxuA:
undetectable		 4qzuC-3zxuA:
20.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4a60 FATTY ACID-BINDING
PROTEIN 9 TESTIS
LIPID-BINDING
PROTEIN, TLBP,
TESTIS-TYPE FATTY
ACID-BINDING
PROTEIN, T-FABP

(Homo sapiens) 		PF00061
(Lipocalin) 		4 TYR A  20
GLU A  73
THR A  75
GLN A  96
 None
None
EDO  A1134 ( 4.9A)
None
 0.81A 4qzuC-4a60A:
19.9		 4qzuC-4a60A:
30.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4azn FATTY ACID-BINDING
PROTEIN, EPIDERMAL

(Mus musculus) 		PF00061
(Lipocalin) 		4 TYR A  22
GLU A  75
THR A  77
GLN A  98
 None
 0.64A 4qzuC-4aznA:
20.1		 4qzuC-4aznA:
28.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4azp FATTY ACID-BINDING
PROTEIN, EPIDERMAL

(Mus musculus) 		PF00061
(Lipocalin) 		4 TYR A  22
GLU A  75
THR A  77
GLN A  98
 None
 0.64A 4qzuC-4azpA:
21.1		 4qzuC-4azpA:
31.51
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.
4ber PHOSPHOCHOLINE
TRANSFERASE ANKX

(Legionella
pneumophila) 		PF02661
(Fic)
PF12796
(Ank_2) 		4 TYR A 201
GLU A  69
GLN A 250
LEU A  72
 None
 1.38A 4qzuC-4berA:
undetectable		 4qzuC-4berA:
15.40
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.
4j9v POTASSIUM UPTAKE
PROTEIN TRKA

(Vibrio
parahaemolyticus) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		4 TYR A 132
GLU A 208
GLN A 340
LEU A 136
 None
 1.16A 4qzuC-4j9vA:
undetectable		 4qzuC-4j9vA:
14.93
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.
4kf7 NUP188

(Thermothelomyces
thermophila) 		PF10487
(Nup188) 		4 TYR A 863
GLN A 560
TRP A 562
LEU A 867
 None
 1.26A 4qzuC-4kf7A:
undetectable		 4qzuC-4kf7A:
8.69
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.
4l87 SERINE--TRNA LIGASE,
CYTOPLASMIC

(Homo sapiens) 		PF00587
(tRNA-synt_2b)
PF02403
(Seryl_tRNA_N) 		4 TYR A 220
GLU A 350
THR A 346
LEU A 215
 None
 1.31A 4qzuC-4l87A:
undetectable		 4qzuC-4l87A:
16.23
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.
4mk0 BETA-ADRENERGIC
RECEPTOR KINASE 1

(Homo sapiens) 		PF00069
(Pkinase)
PF00169
(PH)
PF00615
(RGS) 		4 GLU A 537
THR A 533
GLN A 176
LEU A  67
 None
 1.03A 4qzuC-4mk0A:
undetectable		 4qzuC-4mk0A:
12.09
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.
4n83 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SUBUNIT BETA

(Streptococcus
sanguinis) 		PF00268
(Ribonuc_red_sm) 		4 GLU A 116
THR A 113
TRP A  44
LEU A  41
 None
 1.18A 4qzuC-4n83A:
undetectable		 4qzuC-4n83A:
16.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nns FATTY ACID-BINDING
PROTEIN, ADIPOCYTE

(Homo sapiens) 		PF00061
(Lipocalin) 		4 TYR A  19
GLU A  72
THR A  74
GLN A  95
 None
 0.75A 4qzuC-4nnsA:
20.7		 4qzuC-4nnsA:
33.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r6h SOLUTE BINDING
PROTEIN MSME

(Bacillus
subtilis) 		PF01547
(SBP_bac_1) 		4 TYR A  54
GLU A 286
THR A 289
TRP A  76
 None
 1.36A 4qzuC-4r6hA:
undetectable		 4qzuC-4r6hA:
17.69
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.
4u3q 17 KDA LIPOPROTEIN

(Treponema
pallidum) 		PF04170
(NlpE) 		4 TYR A  98
GLU A  53
THR A  39
LEU A  81
 None
 0.94A 4qzuC-4u3qA:
2.2		 4qzuC-4u3qA:
27.41
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.
4wvm STONUSTOXIN SUBUNIT
ALPHA

(Synanceia
horrida) 		PF00622
(SPRY)
PF13765
(PRY) 		4 TYR A 495
THR A 480
GLN A 389
LEU A 500
 None
 0.97A 4qzuC-4wvmA:
undetectable		 4qzuC-4wvmA:
11.71
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.
4wzh DIHYDROOROTATE
DEHYDROGENASE

(Leishmania
braziliensis) 		PF01180
(DHO_dh) 		4 TYR A 225
GLU A 277
THR A 273
LEU A  64
 None
None
FMN  A 401 (-3.5A)
None
 1.24A 4qzuC-4wzhA:
undetectable		 4qzuC-4wzhA:
16.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5b29 FATTY ACID-BINDING
PROTEIN, HEART

(Homo sapiens) 		PF00061
(Lipocalin) 		5 TYR A  19
GLU A  72
THR A  74
GLN A  95
LEU A 117
 None
 0.75A 4qzuC-5b29A:
21.1		 4qzuC-5b29A:
40.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5bvt EPIDERMAL FATTY
ACID-BINDING PROTEIN

(Pygoscelis
papua) 		PF00061
(Lipocalin) 		4 TYR A  22
GLU A  75
THR A  77
GLN A  99
 None
 0.70A 4qzuC-5bvtA:
20.2		 4qzuC-5bvtA:
32.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bwa ORNITHINE
DECARBOXYLASE

(Homo sapiens) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		4 TYR A 230
GLU A 106
GLN A 129
LEU A 231
 None
 1.28A 4qzuC-5bwaA:
undetectable		 4qzuC-5bwaA:
14.22
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.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1
CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCOP1

(Pseudomonas
stutzeri;
Pseudomonas
stutzeri) 		PF00115
(COX1)
PF13442
(Cytochrome_CBB3)
PF14715
(FixP_N) 		4 TYR C  76
THR A 331
GLN C  98
LEU C  86
 None
PO4  A 506 (-3.4A)
None
None
 1.36A 4qzuC-5djqC:
undetectable		 4qzuC-5djqC:
18.39
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.
5eeb ALDEHYDE
DEHYDROGENASE

(Pyrobaculum
ferrireducens) 		PF00171
(Aldedh) 		4 TYR A 177
GLU A  95
THR A 183
LEU A 206
 None
 1.24A 4qzuC-5eebA:
undetectable		 4qzuC-5eebA:
13.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5gkb FATTY ACID BINDIN
PROTEIN, ISOFORM B

(Drosophila
melanogaster) 		PF00061
(Lipocalin) 		5 TYR A  19
GLU A  72
THR A  74
GLN A  95
LEU A 116
 None
 0.99A 4qzuC-5gkbA:
19.9		 4qzuC-5gkbA:
34.59
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.
5hyo PEDV 3CLPRO

(Porcine
epidemic
diarrhea virus) 		PF05409
(Peptidase_C30) 		4 TYR A 102
THR A  35
GLN A  87
LEU A 176
 IPA  A 405 (-4.6A)
IPA  A 405 (-3.9A)
IPA  A 405 (-3.4A)
None
 1.04A 4qzuC-5hyoA:
undetectable		 4qzuC-5hyoA:
19.74
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.
5hz5 FATTY ACID-BINDING
PROTEIN, EPIDERMAL

(Homo sapiens) 		PF00061
(Lipocalin) 		4 TYR A  22
GLU A  75
THR A  77
GLN A  98
 65X  A 203 ( 4.7A)
None
None
None
 0.59A 4qzuC-5hz5A:
20.9		 4qzuC-5hz5A:
28.68
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.
5lp4 PENICILLIN-BINDING
PROTEIN 2 (PBP2)

(Helicobacter
pylori) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 GLU A 389
THR A 386
GLN A 477
LEU A 481
 None
 1.29A 4qzuC-5lp4A:
undetectable		 4qzuC-5lp4A:
15.48
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.
5odo ISOMERASE

(Rhodococcus
erythropolis) 		no annotation 4 GLU A  84
THR A 538
GLN A 516
LEU A 507
 None
 1.40A 4qzuC-5odoA:
undetectable		 4qzuC-5odoA:
12.86
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.
5t0h 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 2

(Homo sapiens) 		PF00004
(AAA) 		4 TYR f 660
GLU f 677
THR f 673
LEU f 612
 None
 1.38A 4qzuC-5t0hf:
undetectable		 4qzuC-5t0hf:
10.98
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.
5uuu BETA-ADRENERGIC
RECEPTOR KINASE 1

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		4 GLU A 537
THR A 533
GLN A 176
LEU A  67
 None
 1.14A 4qzuC-5uuuA:
undetectable		 4qzuC-5uuuA:
13.38
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.
5yjj POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Staphylococcus
epidermidis) 		no annotation 4 GLU A 332
THR A 348
GLN A  23
LEU A 337
 None
 1.25A 4qzuC-5yjjA:
undetectable		 4qzuC-5yjjA:
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.
6a8m -

(-) 		no annotation 4 TYR A 298
THR A  11
TRP A 174
LEU A 371
 None
 1.34A 4qzuC-6a8mA:
undetectable		 4qzuC-6a8mA:
undetectable