SIMILAR PATTERNS OF AMINO ACIDS FOR 4QOG_B_ML1B302_1

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.
1a2v METHYLAMINE OXIDASE

(Ogataea angusta) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		4 GLY A 470
PHE A 648
ILE A 292
PHE A 649
 None
 1.03A 4qogA-1a2vA:
0.0
4qogB-1a2vA:
0.0		 4qogA-1a2vA:
16.69
4qogB-1a2vA:
16.69
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.
1ef1 MOESIN

(Homo sapiens) 		PF00373
(FERM_M)
PF00769
(ERM)
PF09379
(FERM_N)
PF09380
(FERM_C) 		4 GLY A 213
PHE C 574
ILE A 208
PHE A 267
 None
 1.10A 4qogA-1ef1A:
0.0
4qogB-1ef1A:
0.0		 4qogA-1ef1A:
22.00
4qogB-1ef1A:
22.00
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.
1eov ASPARTYL-TRNA
SYNTHETASE

(Saccharomyces
cerevisiae) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 GLY A 526
PHE A 362
ILE A 479
PHE A 366
 None
 0.97A 4qogA-1eovA:
0.0
4qogB-1eovA:
0.0		 4qogA-1eovA:
18.76
4qogB-1eovA:
18.76
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.
1f7u ARGINYL-TRNA
SYNTHETASE

(Saccharomyces
cerevisiae) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		4 GLY A 207
PHE A 269
ILE A 265
PHE A 196
 None
 1.05A 4qogA-1f7uA:
4.2
4qogB-1f7uA:
4.4		 4qogA-1f7uA:
18.06
4qogB-1f7uA:
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.
1ty2 PUTATIVE EXOTOXIN
(SUPERANTIGEN)

(Streptococcus
pyogenes) 		PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C) 		4 GLY A 106
PHE A 201
ILE A 162
PHE A 129
 None
 0.91A 4qogA-1ty2A:
0.0
4qogB-1ty2A:
0.0		 4qogA-1ty2A:
22.03
4qogB-1ty2A:
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.
1tye INTEGRIN BETA-3

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		4 GLY B 221
PHE B 248
ILE B 226
PHE B 308
 None
 0.83A 4qogA-1tyeB:
5.0
4qogB-1tyeB:
5.0		 4qogA-1tyeB:
19.25
4qogB-1tyeB:
19.25
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.
1vmo VITELLINE MEMBRANE
OUTER LAYER PROTEIN
I

(Gallus gallus) 		PF03762
(VOMI) 		4 GLY A  14
PHE A  87
ILE A 106
PHE A 159
 None
 1.01A 4qogA-1vmoA:
0.0
4qogB-1vmoA:
0.0		 4qogA-1vmoA:
18.42
4qogB-1vmoA:
18.42
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.
1vmo VITELLINE MEMBRANE
OUTER LAYER PROTEIN
I

(Gallus gallus) 		PF03762
(VOMI) 		4 GLY A 120
PHE A  34
ILE A  53
PHE A 108
 None
 1.05A 4qogA-1vmoA:
0.0
4qogB-1vmoA:
0.0		 4qogA-1vmoA:
18.42
4qogB-1vmoA:
18.42
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.
1w3f HEMOLYTIC LECTIN
FROM LAETIPORUS
SULPHUREUS

(Laetiporus
sulphureus) 		PF03318
(ETX_MTX2) 		4 TRP A 238
GLY A 300
GLN A 198
PHE A 246
 None
 1.09A 4qogA-1w3fA:
0.0
4qogB-1w3fA:
0.0		 4qogA-1w3fA:
21.12
4qogB-1w3fA:
21.12
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.
2aaz THYMIDYLATE SYNTHASE

(Cryptococcus
neoformans) 		PF00303
(Thymidylat_synt) 		4 TRP A 282
GLY A 290
PHE A 295
ILE A 292
 None
 1.05A 4qogA-2aazA:
undetectable
4qogB-2aazA:
undetectable		 4qogA-2aazA:
21.94
4qogB-2aazA:
21.94
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.
2acv TRITERPENE
UDP-GLUCOSYL
TRANSFERASE UGT71G1

(Medicago
truncatula) 		PF00201
(UDPGT) 		4 GLY A 245
PHE A 141
ILE A 216
PHE A  14
 None
 1.10A 4qogA-2acvA:
3.6
4qogB-2acvA:
3.9		 4qogA-2acvA:
19.91
4qogB-2acvA:
19.91
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.
2akj FERREDOXIN--NITRITE
REDUCTASE,
CHLOROPLAST

(Spinacia
oleracea) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		4 GLY A 517
GLN A 550
PHE A 551
ILE A 546
 None
 0.96A 4qogA-2akjA:
undetectable
4qogB-2akjA:
undetectable		 4qogA-2akjA:
17.63
4qogB-2akjA:
17.63
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.
2dum HYPOTHETICAL PROTEIN
PH0823

(Pyrococcus
horikoshii) 		PF00582
(Usp) 		4 GLY A  17
PHE A  10
ILE A 154
PHE A  91
 None
 1.02A 4qogA-2dumA:
undetectable
4qogB-2dumA:
undetectable		 4qogA-2dumA:
22.18
4qogB-2dumA:
22.18
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.
2gpc IRON SUPEROXIDE
DISMUTASE

(Trypanosoma
cruzi) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 TRP A 126
GLN A 193
PHE A  77
PHE A  73
 None
 1.02A 4qogA-2gpcA:
undetectable
4qogB-2gpcA:
undetectable		 4qogA-2gpcA:
20.92
4qogB-2gpcA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hcb CHROMOSOMAL
REPLICATION
INITIATOR PROTEIN
DNAA

(Aquifex
aeolicus) 		PF00308
(Bac_DnaA)
PF08299
(Bac_DnaA_C) 		4 GLY A 234
PHE A 199
ILE A 209
PHE A 195
 None
 0.89A 4qogA-2hcbA:
undetectable
4qogB-2hcbA:
undetectable		 4qogA-2hcbA:
22.75
4qogB-2hcbA:
22.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ozk URIDYLATE-SPECIFIC
ENDORIBONUCLEASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF06471
(NSP11) 		4 GLY A 253
PHE A 240
ILE A 295
PHE A 329
 None
 1.08A 4qogA-2ozkA:
undetectable
4qogB-2ozkA:
undetectable		 4qogA-2ozkA:
22.44
4qogB-2ozkA:
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.
2q1f CHONDROITINASE

(Bacteroides
thetaiotaomicron) 		PF02278
(Lyase_8)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		4 GLY A 406
PHE A 427
ILE A 411
PHE A 476
 None
 0.94A 4qogA-2q1fA:
undetectable
4qogB-2q1fA:
undetectable		 4qogA-2q1fA:
12.54
4qogB-2q1fA:
12.54
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.
2v41 PEROXIREDOXIN 6.

(Arenicola
marina) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 GLY A  32
PHE A  23
ILE A  67
PHE A  12
 None
 1.06A 4qogA-2v41A:
undetectable
4qogB-2v41A:
undetectable		 4qogA-2v41A:
22.85
4qogB-2v41A:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vyc BIODEGRADATIVE
ARGININE
DECARBOXYLASE

(Escherichia
coli) 		PF01276
(OKR_DC_1)
PF03709
(OKR_DC_1_N)
PF03711
(OKR_DC_1_C) 		4 TRP A 474
GLY A 635
PHE A 601
PHE A 476
 None
 1.05A 4qogA-2vycA:
6.9
4qogB-2vycA:
7.0		 4qogA-2vycA:
16.10
4qogB-2vycA:
16.10
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.
2w3y VIRULENCE FACTOR

(Pectobacterium
carotovorum) 		no annotation 4 GLY A 152
PHE A 198
ILE A 205
PHE A 219
 PLM  A1278 ( 4.2A)
None
None
PLM  A1278 ( 3.7A)
 1.01A 4qogA-2w3yA:
undetectable
4qogB-2w3yA:
undetectable		 4qogA-2w3yA:
21.58
4qogB-2w3yA:
21.58
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.
2wb7 PT26-6P

(Thermococcus
sp. 26-2) 		no annotation 4 GLY A 475
PHE A 483
ILE A 433
PHE A 453
 None
 0.99A 4qogA-2wb7A:
undetectable
4qogB-2wb7A:
undetectable		 4qogA-2wb7A:
17.84
4qogB-2wb7A:
17.84
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.
2wjv REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		4 TRP A 739
GLY A 784
PHE A 836
ILE A 790
 None
 1.06A 4qogA-2wjvA:
undetectable
4qogB-2wjvA:
undetectable		 4qogA-2wjvA:
15.04
4qogB-2wjvA:
15.04
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.
2xzo REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF13086
(AAA_11)
PF13087
(AAA_12) 		4 TRP A 739
GLY A 784
PHE A 836
ILE A 790
 None
 1.08A 4qogA-2xzoA:
undetectable
4qogB-2xzoA:
undetectable		 4qogA-2xzoA:
18.53
4qogB-2xzoA:
18.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zwa LEUCINE CARBOXYL
METHYLTRANSFERASE 2

(Saccharomyces
cerevisiae) 		PF04072
(LCM)
PF13418
(Kelch_4) 		4 GLY A 558
PHE A 534
ILE A 555
PHE A 535
 None
 0.98A 4qogA-2zwaA:
undetectable
4qogB-2zwaA:
undetectable		 4qogA-2zwaA:
15.25
4qogB-2zwaA:
15.25
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.
3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE

(Bifidobacterium
longum) 		PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N) 		4 GLY A 110
GLN A 105
ILE A 371
PHE A 143
 None
 1.09A 4qogA-3ai7A:
2.6
4qogB-3ai7A:
3.6		 4qogA-3ai7A:
13.29
4qogB-3ai7A:
13.29
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.
3cqn VIOLAXANTHIN
DE-EPOXIDASE,
CHLOROPLAST

(Arabidopsis
thaliana) 		PF07137
(VDE) 		4 TRP A 179
GLY A 163
PHE A  99
ILE A  96
 None
 1.07A 4qogA-3cqnA:
undetectable
4qogB-3cqnA:
undetectable		 4qogA-3cqnA:
20.43
4qogB-3cqnA:
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.
3eh7 4-HYDROXYBUTYRATE
COA-TRANSFERASE

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		4 GLY A  65
GLN A 331
ILE A 217
PHE A 270
 None
 1.02A 4qogA-3eh7A:
undetectable
4qogB-3eh7A:
undetectable		 4qogA-3eh7A:
21.41
4qogB-3eh7A:
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.
3esf IRON-CONTAINING
SUPEROXIDE DISMUTASE
B2

(Trypanosoma
brucei) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 TRP A 127
GLN A 194
PHE A  78
PHE A  74
 None
 0.95A 4qogA-3esfA:
undetectable
4qogB-3esfA:
undetectable		 4qogA-3esfA:
21.25
4qogB-3esfA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fk3 PROTEIN AF-9 HOMOLOG

(Saccharomyces
cerevisiae) 		PF03366
(YEATS) 		4 GLY A  49
PHE A  58
ILE A  59
PHE A 155
 None
 0.93A 4qogA-3fk3A:
undetectable
4qogB-3fk3A:
undetectable		 4qogA-3fk3A:
19.41
4qogB-3fk3A:
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.
3gec PERIOD CIRCADIAN
PROTEIN

(Drosophila
melanogaster) 		PF00989
(PAS)
PF14598
(PAS_11) 		4 GLY A 421
PHE A 427
ILE A 424
PHE A 461
 None
 1.03A 4qogA-3gecA:
undetectable
4qogB-3gecA:
undetectable		 4qogA-3gecA:
21.71
4qogB-3gecA:
21.71
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.
3h1s SUPEROXIDE DISMUTASE

(Francisella
tularensis) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 TRP A 124
GLN A 189
PHE A  76
PHE A  72
 None
 0.99A 4qogA-3h1sA:
undetectable
4qogB-3h1sA:
undetectable		 4qogA-3h1sA:
23.69
4qogB-3h1sA:
23.69
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.
3hig AMILORIDE-SENSITIVE
AMINE OXIDASE

(Homo sapiens) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		4 GLY A 524
PHE A 701
ILE A 346
PHE A 702
 None
 0.80A 4qogA-3higA:
undetectable
4qogB-3higA:
undetectable		 4qogA-3higA:
15.94
4qogB-3higA:
15.94
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.
3i0w 8-OXOGUANINE-DNA-GLY
COSYLASE

(Clostridium
acetobutylicum) 		PF00730
(HhH-GPD)
PF07934
(OGG_N) 		4 GLY A  45
PHE A  79
ILE A  63
PHE A  21
 None
 1.04A 4qogA-3i0wA:
undetectable
4qogB-3i0wA:
undetectable		 4qogA-3i0wA:
21.75
4qogB-3i0wA:
21.75
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.
3iuz PUTATIVE GLYOXALASE
SUPERFAMILY PROTEIN

(Cupriavidus
pinatubonensis) 		PF07063
(DUF1338) 		4 GLY A  63
PHE A  53
ILE A  56
PHE A  79
 None
 0.75A 4qogA-3iuzA:
undetectable
4qogB-3iuzA:
undetectable		 4qogA-3iuzA:
21.68
4qogB-3iuzA:
21.68
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.
3jtx AMINOTRANSFERASE

(Neisseria
meningitidis) 		PF00155
(Aminotran_1_2) 		4 TRP A 165
GLN A 196
PHE A 201
ILE A 203
 None
 1.03A 4qogA-3jtxA:
undetectable
4qogB-3jtxA:
undetectable		 4qogA-3jtxA:
20.91
4qogB-3jtxA:
20.91
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.
3l84 TRANSKETOLASE

(Campylobacter
jejuni) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 GLY A 366
PHE A 410
ILE A 438
PHE A 358
 None
 1.09A 4qogA-3l84A:
4.2
4qogB-3l84A:
4.1		 4qogA-3l84A:
17.74
4qogB-3l84A:
17.74
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.
3l8e D,D-HEPTOSE
1,7-BISPHOSPHATE
PHOSPHATASE

(Escherichia
coli) 		PF13242
(Hydrolase_like) 		4 TRP A  74
PHE A  31
ILE A  16
PHE A  29
 None
 1.10A 4qogA-3l8eA:
undetectable
4qogB-3l8eA:
undetectable		 4qogA-3l8eA:
23.20
4qogB-3l8eA:
23.20
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.
3led 3-OXOACYL-ACYL
CARRIER PROTEIN
SYNTHASE III

(Rhodopseudomonas
palustris) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 GLY A 261
PHE A 257
ILE A 235
PHE A 201
 None
 1.04A 4qogA-3ledA:
undetectable
4qogB-3ledA:
undetectable		 4qogA-3ledA:
20.20
4qogB-3ledA:
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.
3n2o BIOSYNTHETIC
ARGININE
DECARBOXYLASE

(Vibrio
vulnificus) 		PF02784
(Orn_Arg_deC_N) 		4 GLY A 327
PHE A 290
ILE A 322
PHE A 254
 None
 1.08A 4qogA-3n2oA:
undetectable
4qogB-3n2oA:
undetectable		 4qogA-3n2oA:
15.77
4qogB-3n2oA:
15.77
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.
3nix FLAVOPROTEIN/DEHYDRO
GENASE

(Cytophaga
hutchinsonii) 		PF01494
(FAD_binding_3) 		4 GLY A 203
GLN A 102
ILE A 206
PHE A  89
 None
 1.06A 4qogA-3nixA:
undetectable
4qogB-3nixA:
undetectable		 4qogA-3nixA:
19.62
4qogB-3nixA:
19.62
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.
3nzq BIOSYNTHETIC
ARGININE
DECARBOXYLASE

(Escherichia
coli) 		PF02784
(Orn_Arg_deC_N) 		4 GLY A 344
PHE A 307
ILE A 339
PHE A 271
 None
 1.02A 4qogA-3nzqA:
undetectable
4qogB-3nzqA:
undetectable		 4qogA-3nzqA:
15.77
4qogB-3nzqA:
15.77
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.
3o7o ENDOGLUCANASE

(Thermotoga
maritima) 		PF01670
(Glyco_hydro_12) 		4 GLY A 234
PHE A 243
ILE A  51
PHE A  47
 None
 1.04A 4qogA-3o7oA:
undetectable
4qogB-3o7oA:
undetectable		 4qogA-3o7oA:
23.76
4qogB-3o7oA:
23.76
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.
3rhg PUTATIVE
PHOPHOTRIESTERASE

(Proteus
mirabilis) 		PF02126
(PTE) 		4 GLY A 306
GLN A 299
ILE A 259
PHE A 296
 None
None
None
CAC  A 370 (-3.5A)
 1.08A 4qogA-3rhgA:
undetectable
4qogB-3rhgA:
undetectable		 4qogA-3rhgA:
20.16
4qogB-3rhgA:
20.16
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.
3rty PERIOD CIRCADIAN
PROTEIN

(Drosophila
melanogaster) 		PF00989
(PAS)
PF14598
(PAS_11) 		4 GLY A 421
PHE A 427
ILE A 424
PHE A 461
 None
 1.04A 4qogA-3rtyA:
undetectable
4qogB-3rtyA:
undetectable		 4qogA-3rtyA:
20.90
4qogB-3rtyA:
20.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3te7 RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE]

(Homo sapiens) 		PF02525
(Flavodoxin_2) 		5 GLY A  68
GLN A 122
PHE A 126
ILE A 128
PHE A 178
 TE7  A   1 ( 4.1A)
TE7  A   1 ( 4.3A)
TE7  A   1 (-4.3A)
None
TE7  A   1 (-3.6A)
 0.72A 4qogA-3te7A:
39.8
4qogB-3te7A:
38.8		 4qogA-3te7A:
100.00
4qogB-3te7A:
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.
3v4v INTEGRIN BETA-7

(Homo sapiens) 		PF00362
(Integrin_beta) 		4 GLY B 241
PHE B 267
ILE B 246
PHE B 327
 None
 0.74A 4qogA-3v4vB:
3.6
4qogB-3v4vB:
3.4		 4qogA-3v4vB:
18.82
4qogB-3v4vB:
18.82
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.
3x3y PHENYLETHYLAMINE
OXIDASE

(Arthrobacter
globiformis) 		PF01179
(Cu_amine_oxid)
PF02728
(Cu_amine_oxidN3) 		4 GLY A 445
PHE A 616
ILE A 271
PHE A 617
 None
 1.06A 4qogA-3x3yA:
undetectable
4qogB-3x3yA:
undetectable		 4qogA-3x3yA:
17.21
4qogB-3x3yA:
17.21
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.
4ayj BOGT -
METAL-INDEPENDENT
GLYCOSYLTRANSFERASE

(Bacteroides
ovatus) 		PF03414
(Glyco_transf_6) 		4 GLY A 160
PHE A  94
ILE A   5
PHE A 100
 None
 1.06A 4qogA-4ayjA:
undetectable
4qogB-4ayjA:
undetectable		 4qogA-4ayjA:
20.23
4qogB-4ayjA:
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.
4bhh NUCLEOPROTEIN

(California
encephalitis
orthobunyavirus) 		PF00952
(Bunya_nucleocap) 		4 GLY B  97
PHE B  42
ILE B  92
PHE B  65
 None
 1.04A 4qogA-4bhhB:
undetectable
4qogB-4bhhB:
undetectable		 4qogA-4bhhB:
20.00
4qogB-4bhhB:
20.00
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.
4cak INTEGRIN BETA-3

(Homo sapiens) 		PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF17205
(PSI_integrin) 		4 GLY B 221
PHE B 248
ILE B 226
PHE B 308
 None
 0.86A 4qogA-4cakB:
2.2
4qogB-4cakB:
undetectable		 4qogA-4cakB:
15.23
4qogB-4cakB:
15.23
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.
4dh2 CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION

(Ruminiclostridium
thermocellum) 		PF00963
(Cohesin) 		4 GLY A 102
PHE A  93
ILE A  71
PHE A  49
 None
 1.09A 4qogA-4dh2A:
undetectable
4qogB-4dh2A:
undetectable		 4qogA-4dh2A:
24.47
4qogB-4dh2A:
24.47
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.
4f4f THREONINE SYNTHASE

(Brucella
melitensis) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		4 GLY A 293
PHE A 316
ILE A 354
PHE A 257
 None
 0.99A 4qogA-4f4fA:
undetectable
4qogB-4f4fA:
undetectable		 4qogA-4f4fA:
16.18
4qogB-4f4fA:
16.18
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.
4j72 PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE

(Aquifex
aeolicus) 		PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1) 		4 GLY A  78
PHE A 107
ILE A 271
PHE A 240
 None
 0.99A 4qogA-4j72A:
undetectable
4qogB-4j72A:
undetectable		 4qogA-4j72A:
23.02
4qogB-4j72A:
23.02
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.
4jhz BETA-GLUCURONIDASE

(Escherichia
coli) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		4 GLY A 245
PHE A 288
ILE A 283
PHE A 290
 None
 1.06A 4qogA-4jhzA:
undetectable
4qogB-4jhzA:
undetectable		 4qogA-4jhzA:
18.90
4qogB-4jhzA:
18.90
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.
4jo8 M157

(Murid
betaherpesvirus
1) 		PF11624
(M157) 		4 GLY A 170
GLN A 102
PHE A  98
ILE A 101
 None
 0.96A 4qogA-4jo8A:
undetectable
4qogB-4jo8A:
undetectable		 4qogA-4jo8A:
24.11
4qogB-4jo8A:
24.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kq7 HYPOTHETICAL PROTEIN

(Bacteroides
uniformis) 		PF11175
(DUF2961) 		4 GLY A 348
PHE A 298
ILE A 350
PHE A 299
 None
 1.01A 4qogA-4kq7A:
undetectable
4qogB-4kq7A:
undetectable		 4qogA-4kq7A:
19.89
4qogB-4kq7A:
19.89
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.
4kq9 RIBOSE ABC
TRANSPORTER,
SUBSTRATE BINDING
PROTEIN

(Conexibacter
woesei) 		PF13407
(Peripla_BP_4) 		4 GLY A 264
GLN A 189
PHE A 185
ILE A 156
 None
None
GOL  A 502 (-3.9A)
None
 1.07A 4qogA-4kq9A:
6.1
4qogB-4kq9A:
6.0		 4qogA-4kq9A:
21.19
4qogB-4kq9A:
21.19
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.
4n7c BLA G 4 ALLERGEN
VARIANT 1

(Blattella
germanica) 		PF03973
(Triabin) 		4 GLY A 111
PHE A  81
ILE A  83
PHE A  49
 None
 0.94A 4qogA-4n7cA:
undetectable
4qogB-4n7cA:
undetectable		 4qogA-4n7cA:
24.03
4qogB-4n7cA:
24.03
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.
4nen INTEGRIN ALPHA-X
INTEGRIN BETA-2

(Homo sapiens) 		PF00092
(VWA)
PF00362
(Integrin_beta)
PF01839
(FG-GAP)
PF07965
(Integrin_B_tail)
PF08441
(Integrin_alpha2)
PF17205
(PSI_integrin) 		4 GLY A 412
PHE B 247
ILE A 435
PHE B 245
 None
 0.78A 4qogA-4nenA:
4.5
4qogB-4nenA:
4.5		 4qogA-4nenA:
11.30
4qogB-4nenA:
11.30
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.
4p0f SERINE PROTEASE
INHIBITOR 4, ISOFORM
B

(Drosophila
melanogaster) 		PF00079
(Serpin) 		4 GLY A  64
PHE A  77
ILE A  73
PHE A 116
 None
 0.94A 4qogA-4p0fA:
undetectable
4qogB-4p0fA:
undetectable		 4qogA-4p0fA:
23.21
4qogB-4p0fA:
23.21
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.
4qc8 VP2

(Ungulate
bocaparvovirus
1) 		PF00740
(Parvo_coat) 		4 TRP A 189
GLY A 474
PHE A 100
PHE A 102
 None
 1.00A 4qogA-4qc8A:
undetectable
4qogB-4qc8A:
undetectable		 4qogA-4qc8A:
17.66
4qogB-4qc8A:
17.66
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.
4qlj BETA-GLUCOSIDASE 7

(Oryza sativa) 		PF00232
(Glyco_hydro_1) 		4 GLY A 388
PHE A 470
ILE A 451
PHE A  82
 None
 1.05A 4qogA-4qljA:
undetectable
4qogB-4qljA:
undetectable		 4qogA-4qljA:
19.01
4qogB-4qljA:
19.01
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.
4qp0 ENDO-BETA-MANNANASE

(Rhizomucor
miehei) 		PF00150
(Cellulase) 		4 GLY A 218
PHE A 252
ILE A 290
PHE A 168
 None
 1.10A 4qogA-4qp0A:
undetectable
4qogB-4qp0A:
undetectable		 4qogA-4qp0A:
19.71
4qogB-4qp0A:
19.71
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.
4re2 BETA-MANNOSIDASE/BET
A-GLUCOSIDASE

(Oryza sativa) 		PF00232
(Glyco_hydro_1) 		4 GLY A 391
PHE A 473
ILE A 454
PHE A  85
 None
 1.09A 4qogA-4re2A:
undetectable
4qogB-4re2A:
undetectable		 4qogA-4re2A:
18.91
4qogB-4re2A:
18.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rsl FRUCTOSYL PEPTIDE
OXIDASE

(Penicillium
terrenum) 		PF01266
(DAO) 		4 TRP A 149
GLY A 263
PHE A 332
PHE A 141
 None
 0.97A 4qogA-4rslA:
undetectable
4qogB-4rslA:
undetectable		 4qogA-4rslA:
20.85
4qogB-4rslA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rv3 1-PHOSPHATIDYLINOSIT
OL PHOSPHODIESTERASE

(Staphylococcus
aureus) 		PF00388
(PI-PLC-X) 		4 GLY A  60
PHE A  64
ILE A 108
PHE A  92
 None
 0.96A 4qogA-4rv3A:
undetectable
4qogB-4rv3A:
undetectable		 4qogA-4rv3A:
22.76
4qogB-4rv3A:
22.76
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.
4txv CYTOCHROME C OXIDASE
SUBUNIT 2

(Bradyrhizobium
diazoefficiens) 		PF00116
(COX2) 		4 GLY B 223
PHE B 201
ILE B 244
PHE B 217
 None
 1.01A 4qogA-4txvB:
undetectable
4qogB-4txvB:
undetectable		 4qogA-4txvB:
25.00
4qogB-4txvB:
25.00
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.
4ubt ACETYL-COA
ACETYLTRANSFERASE
FADA5

(Mycobacterium
tuberculosis) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 TRP A 257
GLY A  96
GLN A  97
ILE A 374
 None
 0.95A 4qogA-4ubtA:
undetectable
4qogB-4ubtA:
undetectable		 4qogA-4ubtA:
20.96
4qogB-4ubtA:
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.
4um8 INTEGRIN BETA-6

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		4 GLY B 224
PHE B 251
ILE B 229
PHE B 311
 None
 0.73A 4qogA-4um8B:
3.8
4qogB-4um8B:
3.6		 4qogA-4um8B:
15.00
4qogB-4um8B:
15.00
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.
4v2x ENDO-BETA-1,4-GLUCAN
ASE (CELLULASE B)

(Bacillus
halodurans) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		4 GLY A 467
PHE A 527
ILE A 551
PHE A 526
 None
 1.09A 4qogA-4v2xA:
2.1
4qogB-4v2xA:
undetectable		 4qogA-4v2xA:
18.10
4qogB-4v2xA:
18.10
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.
4wk0 INTEGRIN BETA-1

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		4 GLY B 230
PHE B 256
ILE B 235
PHE B 315
 None
 0.74A 4qogA-4wk0B:
4.2
4qogB-4wk0B:
4.0		 4qogA-4wk0B:
18.98
4qogB-4wk0B:
18.98
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.
4z7r COENZYME PQQ
SYNTHESIS PROTEIN B

(Methylobacterium
extorquens) 		PF12706
(Lactamase_B_2) 		4 TRP A 288
GLY A 245
ILE A 241
PHE A 215
 None
 1.09A 4qogA-4z7rA:
undetectable
4qogB-4z7rA:
undetectable		 4qogA-4z7rA:
23.36
4qogB-4z7rA:
23.36
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.
4zxi TYROCIDINE
SYNTHETASE 3

(Acinetobacter
baumannii) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		4 GLY A 511
PHE A 482
ILE A 485
PHE A 616
 None
 0.76A 4qogA-4zxiA:
3.1
4qogB-4zxiA:
undetectable		 4qogA-4zxiA:
10.62
4qogB-4zxiA:
10.62
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.
5a9g MANGANESE SUPEROXIDE
DISMUTASE

(Sphingobacterium
spiritivorum) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 TRP A 125
GLY A 117
ILE A 184
PHE A  79
 None
 1.02A 4qogA-5a9gA:
undetectable
4qogB-5a9gA:
undetectable		 4qogA-5a9gA:
21.26
4qogB-5a9gA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5apm VP1
VP3

(Parechovirus A) 		no annotation 4 GLY A  40
GLN A  37
ILE A  26
PHE B  82
 None
 1.08A 4qogA-5apmA:
undetectable
4qogB-5apmA:
undetectable		 4qogA-5apmA:
21.79
4qogB-5apmA:
21.79
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.
5bwi GLYCOSIDE HYDROLASE
FAMILY 79

(Burkholderia
pseudomallei) 		PF12891
(Glyco_hydro_44) 		4 GLY A 288
PHE A  30
ILE A  26
PHE A 327
 None
 1.05A 4qogA-5bwiA:
undetectable
4qogB-5bwiA:
undetectable		 4qogA-5bwiA:
18.57
4qogB-5bwiA:
18.57
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.
5e6s INTEGRIN ALPHA-L
INTEGRIN BETA-2

(Homo sapiens) 		PF00092
(VWA)
PF00362
(Integrin_beta)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF17205
(PSI_integrin) 		4 GLY A 406
PHE B 247
ILE A 431
PHE B 245
 None
 0.88A 4qogA-5e6sA:
5.8
4qogB-5e6sA:
5.9		 4qogA-5e6sA:
15.33
4qogB-5e6sA:
15.33
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.
5es2 UNCHARACTERIZED
PROTEIN LPG0634

(Legionella
pneumophila) 		PF16848
(SoDot-IcmSS) 		4 GLY A 275
PHE A 248
ILE A 332
PHE A 364
 None
 0.99A 4qogA-5es2A:
undetectable
4qogB-5es2A:
undetectable		 4qogA-5es2A:
21.04
4qogB-5es2A:
21.04
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.
5ffo INTEGRIN BETA-6

(Homo sapiens) 		PF00362
(Integrin_beta) 		4 GLY B 224
PHE B 251
ILE B 229
PHE B 311
 None
 0.79A 4qogA-5ffoB:
4.5
4qogB-5ffoB:
4.4		 4qogA-5ffoB:
20.75
4qogB-5ffoB:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h60 TRANSFERASE

(Escherichia
coli) 		no annotation 4 GLY A 240
PHE A 297
ILE A 293
PHE A 308
 None
 1.03A 4qogA-5h60A:
undetectable
4qogB-5h60A:
undetectable		 4qogA-5h60A:
19.82
4qogB-5h60A:
19.82
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.
5j4r WELO5

(Hapalosiphon
welwitschii) 		no annotation 4 GLY A 275
PHE A 120
ILE A 192
PHE A 114
 None
 0.88A 4qogA-5j4rA:
undetectable
4qogB-5j4rA:
undetectable		 4qogA-5j4rA:
18.86
4qogB-5j4rA:
18.86
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.
5jbg LGP2

(Gallus gallus) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		4 GLY A 618
PHE A 636
ILE A 633
PHE A 552
 None
 1.09A 4qogA-5jbgA:
undetectable
4qogB-5jbgA:
undetectable		 4qogA-5jbgA:
15.09
4qogB-5jbgA:
15.09
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.
5jcf MELANOMA
DIFFERENTIATION
ASSOCIATED PROTEIN-5

(Gallus gallus) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		4 GLY A 944
PHE A 962
ILE A 959
PHE A 879
 None
 1.08A 4qogA-5jcfA:
undetectable
4qogB-5jcfA:
undetectable		 4qogA-5jcfA:
15.70
4qogB-5jcfA:
15.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k1r BURKHOLDERIA
PSEUDOMALLEI
SPHINGOSINE-1-PHOSPH
ATE LYASE BPSS2021

(Burkholderia
pseudomallei) 		PF00282
(Pyridoxal_deC) 		4 GLY A 237
PHE A 342
ILE A 252
PHE A 346
 None
 1.02A 4qogA-5k1rA:
undetectable
4qogB-5k1rA:
undetectable		 4qogA-5k1rA:
19.34
4qogB-5k1rA:
19.34
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.
5kc9 GLUTAMATE RECEPTOR
IONOTROPIC, DELTA-1

(Mus musculus) 		PF01094
(ANF_receptor) 		4 TRP A 343
GLY A  86
ILE A  26
PHE A 334
 None
 1.03A 4qogA-5kc9A:
4.3
4qogB-5kc9A:
2.4		 4qogA-5kc9A:
19.91
4qogB-5kc9A:
19.91
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.
5nem INTEGRIN BETA-6

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		4 GLY B 221
PHE B 248
ILE B 226
PHE B 308
 None
 0.78A 4qogA-5nemB:
3.8
4qogB-5nemB:
undetectable		 4qogA-5nemB:
18.30
4qogB-5nemB:
18.30
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.
5nqf APICAL MEMBRANE
ANTIGEN 1
RHOPTRY NECK PROTEIN
2

(Plasmodium
falciparum;
Plasmodium
vivax) 		PF02430
(AMA-1)
no annotation 		4 GLY B2044
PHE A 276
ILE A 252
PHE A 274
 GLY  B2044 ( 0.0A)
PHE  A 276 ( 1.3A)
ILE  A 252 ( 0.7A)
PHE  A 274 ( 1.3A)
 1.05A 4qogA-5nqfB:
undetectable
4qogB-5nqfB:
undetectable		 4qogA-5nqfB:
10.67
4qogB-5nqfB:
10.67
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.
5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE

(Methanocaldococcus
jannaschii) 		no annotation 4 GLY A 447
GLN A 346
PHE A 355
ILE A 353
 None
 1.04A 4qogA-5od2A:
4.5
4qogB-5od2A:
4.8		 4qogA-5od2A:
18.07
4qogB-5od2A:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uin FORMYLTRANSFERASE

(Salmonella
enterica) 		PF00551
(Formyl_trans_N)
PF13637
(Ank_4) 		4 GLY A   7
PHE A  71
ILE A   4
PHE A  85
 None
 1.07A 4qogA-5uinA:
2.2
4qogB-5uinA:
4.1		 4qogA-5uinA:
18.75
4qogB-5uinA:
18.75
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.
5v3s TWO-COMPONENT
INSECTICIDAL PROTEIN
16 KDA UNIT

(Alcaligenes
faecalis) 		PF06355
(Aegerolysin) 		4 TRP A 101
GLY A 128
ILE A 140
PHE A  87
 None
 0.97A 4qogA-5v3sA:
undetectable
4qogB-5v3sA:
undetectable		 4qogA-5v3sA:
20.17
4qogB-5v3sA:
20.17
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.
5v5x MCG133388, ISOFORM
CRA_Y

(Mus musculus) 		no annotation 4 GLY A 436
PHE A 488
ILE A 439
PHE A 496
 None
 1.09A 4qogA-5v5xA:
undetectable
4qogB-5v5xA:
undetectable		 4qogA-5v5xA:
20.36
4qogB-5v5xA:
20.36
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.
5x2q TASTE RECEPTOR, TYPE
1, MEMBER 2A

(Oryzias latipes) 		PF01094
(ANF_receptor) 		4 GLY A 166
PHE A 262
ILE A 189
PHE A 206
 None
 1.06A 4qogA-5x2qA:
4.5
4qogB-5x2qA:
4.4		 4qogA-5x2qA:
19.83
4qogB-5x2qA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x2q TASTE RECEPTOR, TYPE
1, MEMBER 2A

(Oryzias latipes) 		PF01094
(ANF_receptor) 		4 GLY A 194
PHE A 221
ILE A 189
PHE A 206
 None
 1.10A 4qogA-5x2qA:
4.5
4qogB-5x2qA:
4.4		 4qogA-5x2qA:
19.83
4qogB-5x2qA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bcq TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY M
MEMBER 4

(Mus musculus) 		no annotation 4 TRP B 680
PHE B 779
ILE B 905
PHE B1065
 None
 1.09A 4qogA-6bcqB:
3.4
4qogB-6bcqB:
3.4		 4qogA-6bcqB:
13.85
4qogB-6bcqB:
13.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bfu SPIKE PROTEIN

(Coronavirus
HKU15) 		no annotation 4 GLY A 734
PHE A 656
ILE A 665
PHE A 753
 None
 1.03A 4qogA-6bfuA:
undetectable
4qogB-6bfuA:
undetectable		 4qogA-6bfuA:
12.67
4qogB-6bfuA:
12.67
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.
6c0b TOXIN B

(Clostridioides
difficile) 		no annotation 4 GLY A1529
PHE A1594
ILE A1593
PHE A1604
 None
 1.08A 4qogA-6c0bA:
undetectable
4qogB-6c0bA:
undetectable		 4qogA-6c0bA:
17.24
4qogB-6c0bA:
17.24
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.
6c6k INTERFERON-INDUCED
PROTEIN WITH
TETRATRICOPEPTIDE
REPEATS 1

(Homo sapiens) 		no annotation 4 GLY A 356
GLN A 393
PHE A 389
PHE A 365
 None
 1.06A 4qogA-6c6kA:
undetectable
4qogB-6c6kA:
undetectable		 4qogA-6c6kA:
16.37
4qogB-6c6kA:
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.
6cuf -

(-) 		no annotation 4 GLY 7  30
GLN 7  90
PHE 7  91
ILE 7   2
 None
 0.88A 4qogA-6cuf7:
undetectable
4qogB-6cuf7:
undetectable		 4qogA-6cuf7:
undetectable
4qogB-6cuf7:
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.
6dw1 -

(-) 		no annotation 4 GLY E  39
PHE E  63
ILE E  42
PHE E  98
 None
 1.11A 4qogA-6dw1E:
undetectable
4qogB-6dw1E:
undetectable		 4qogA-6dw1E:
undetectable
4qogB-6dw1E:
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.
6fah CAFFEYL-COA
REDUCTASE-ETF
COMPLEX SUBUNIT CARD
CAFFEYL-COA
REDUCTASE-ETF
COMPLEX SUBUNIT CARE

(Acetobacterium
woodii) 		no annotation 4 TRP B  96
GLY A 218
ILE A  61
PHE A  22
 None
 1.09A 4qogA-6fahB:
undetectable
4qogB-6fahB:
undetectable		 4qogA-6fahB:
18.18
4qogB-6fahB:
18.18