SIMILAR PATTERNS OF AMINO ACIDS FOR 3KO0_T_TFPT202_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.
1b48 PROTEIN (GLUTATHIONE
S-TRANSFERASE)

(Mus musculus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 ASP A 177
SER A 176
PHE A 133
LEU A 170
ILE A 124
 None
 1.28A 3ko0Q-1b48A:
0.0
3ko0R-1b48A:
0.0
3ko0S-1b48A:
undetectable
3ko0T-1b48A:
undetectable		 3ko0Q-1b48A:
17.94
3ko0R-1b48A:
17.94
3ko0S-1b48A:
17.94
3ko0T-1b48A:
17.94
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.
1u08 HYPOTHETICAL
AMINOTRANSFERASE
YBDL

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 GLU A 117
ASP A 116
SER A 161
ILE A 119
PHE A 198
 None
 1.34A 3ko0Q-1u08A:
0.0
3ko0R-1u08A:
0.0
3ko0S-1u08A:
0.0
3ko0T-1u08A:
undetectable		 3ko0Q-1u08A:
13.17
3ko0R-1u08A:
13.17
3ko0S-1u08A:
13.17
3ko0T-1u08A:
13.17
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.
1v38 SAM-DOMAIN PROTEIN
SAMSN-1

(Mus musculus) 		PF07647
(SAM_2) 		5 SER A   6
GLU A  37
ASP A  40
LEU A  32
ILE A  15
 None
 1.34A 3ko0Q-1v38A:
undetectable
3ko0R-1v38A:
undetectable
3ko0S-1v38A:
undetectable
3ko0T-1v38A:
undetectable		 3ko0Q-1v38A:
20.37
3ko0R-1v38A:
20.37
3ko0S-1v38A:
20.37
3ko0T-1v38A:
20.37
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.
1xmj CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF14396
(CFTR_R) 		5 ASP A 579
LEU A 548
SER A 549
ILE A 556
PHE A 575
 None
 1.35A 3ko0Q-1xmjA:
undetectable
3ko0R-1xmjA:
undetectable
3ko0S-1xmjA:
undetectable
3ko0T-1xmjA:
undetectable		 3ko0Q-1xmjA:
17.19
3ko0R-1xmjA:
17.19
3ko0S-1xmjA:
17.19
3ko0T-1xmjA:
17.19
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.
1ybi NON-TOXIN
HAEMAGGLUTININ HA34

(Clostridium
botulinum) 		PF05588
(Botulinum_HA-17)
PF14200
(RicinB_lectin_2) 		5 SER A 135
PHE A 140
ASP A 121
LEU A 129
ILE A  82
 None
 1.29A 3ko0Q-1ybiA:
undetectable
3ko0R-1ybiA:
undetectable
3ko0S-1ybiA:
undetectable
3ko0T-1ybiA:
undetectable		 3ko0Q-1ybiA:
14.58
3ko0R-1ybiA:
14.58
3ko0S-1ybiA:
14.58
3ko0T-1ybiA:
14.58
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.
1yew PARTICULATE METHANE
MONOOXYGENASE, A
SUBUNIT

(Methylococcus
capsulatus) 		PF02461
(AMO) 		5 ASP B  56
LEU B 167
SER B 179
ILE B 164
PHE B 243
 None
 1.30A 3ko0Q-1yewB:
1.3
3ko0R-1yewB:
1.3
3ko0S-1yewB:
1.3
3ko0T-1yewB:
1.3		 3ko0Q-1yewB:
16.80
3ko0R-1yewB:
16.80
3ko0S-1yewB:
16.80
3ko0T-1yewB:
16.80
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.
1ygg PHOSPHOENOLPYRUVATE
CARBOXYKINASE

(Actinobacillus
succinogenes) 		PF01293
(PEPCK_ATP) 		5 ASP A  93
PHE A 193
GLU A 210
ASP A  69
ILE A 202
 None
 1.33A 3ko0Q-1yggA:
0.0
3ko0R-1yggA:
0.0
3ko0S-1yggA:
0.0
3ko0T-1yggA:
undetectable		 3ko0Q-1yggA:
10.18
3ko0R-1yggA:
10.18
3ko0S-1yggA:
10.18
3ko0T-1yggA:
10.18
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.
1ytm PHOSPHOENOLPYRUVATE
CARBOXYKINASE [ATP]

(Anaerobiospirillum
succiniciproducens) 		PF01293
(PEPCK_ATP) 		5 ASP A  86
PHE A 186
GLU A 203
ASP A  64
ILE A 195
 None
 1.36A 3ko0Q-1ytmA:
0.0
3ko0R-1ytmA:
undetectable
3ko0S-1ytmA:
undetectable
3ko0T-1ytmA:
undetectable		 3ko0Q-1ytmA:
11.22
3ko0R-1ytmA:
11.22
3ko0S-1ytmA:
11.22
3ko0T-1ytmA:
11.22
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.
1zp6 HYPOTHETICAL PROTEIN
ATU3015

(Agrobacterium
fabrum) 		PF13238
(AAA_18) 		5 SER A  20
PHE A 144
ASP A  43
LEU A  13
SER A  15
 SO4  A 201 (-3.4A)
None
None
None
None
 1.46A 3ko0Q-1zp6A:
0.0
3ko0R-1zp6A:
undetectable
3ko0S-1zp6A:
0.0
3ko0T-1zp6A:
undetectable		 3ko0Q-1zp6A:
19.37
3ko0R-1zp6A:
19.37
3ko0S-1zp6A:
19.37
3ko0T-1zp6A:
19.37
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.
2q0f RNA URIDYLYL
TRANSFERASE

(Trypanosoma
brucei) 		PF03828
(PAP_assoc) 		5 ASP A  84
PHE A  52
LEU A  49
PHE A  69
ILE A 137
 None
U5P  A 502 ( 4.4A)
None
None
None
 1.47A 3ko0Q-2q0fA:
0.0
3ko0R-2q0fA:
0.0
3ko0S-2q0fA:
undetectable
3ko0T-2q0fA:
undetectable		 3ko0Q-2q0fA:
13.66
3ko0R-2q0fA:
13.66
3ko0S-2q0fA:
13.66
3ko0T-2q0fA:
13.66
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.
2qhp FRUCTOKINASE

(Bacteroides
thetaiotaomicron) 		PF00294
(PfkB) 		5 GLU A 180
ASP A 178
LEU A 154
ILE A 184
PHE A 223
 None
 1.42A 3ko0Q-2qhpA:
0.0
3ko0R-2qhpA:
undetectable
3ko0S-2qhpA:
undetectable
3ko0T-2qhpA:
undetectable		 3ko0Q-2qhpA:
16.61
3ko0R-2qhpA:
16.61
3ko0S-2qhpA:
16.61
3ko0T-2qhpA:
16.61
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.
2qoj INTRON-ENCODED DNA
ENDONUCLEASE I-ANII

(Aspergillus
nidulans) 		PF00961
(LAGLIDADG_1) 		5 SER Z 205
PHE Z 187
LEU Z 216
PHE Z 215
ILE Z 145
 None
 1.33A 3ko0Q-2qojZ:
undetectable
3ko0R-2qojZ:
undetectable
3ko0S-2qojZ:
undetectable
3ko0T-2qojZ:
undetectable		 3ko0Q-2qojZ:
17.93
3ko0R-2qojZ:
17.93
3ko0S-2qojZ:
17.93
3ko0T-2qojZ:
17.93
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.
2qsd UNCHARACTERIZED
CONSERVED PROTEIN

(Idiomarina
loihiensis) 		PF07566
(DUF1543) 		5 ASP A 103
ASP A  26
LEU A  55
SER A  57
PHE A  58
 None
 1.45A 3ko0Q-2qsdA:
undetectable
3ko0R-2qsdA:
undetectable
3ko0S-2qsdA:
undetectable
3ko0T-2qsdA:
undetectable		 3ko0Q-2qsdA:
22.10
3ko0R-2qsdA:
22.10
3ko0S-2qsdA:
22.10
3ko0T-2qsdA:
22.10
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.
2r2i GUANYLYL
CYCLASE-ACTIVATING
PROTEIN 1

(Gallus gallus) 		PF00036
(EF-hand_1)
PF13499
(EF-hand_7) 		5 GLU A 153
LEU A 149
SER A 150
PHE A 154
ILE A 141
 CA  A 502 (-2.3A)
None
None
None
None
 1.43A 3ko0Q-2r2iA:
5.8
3ko0R-2r2iA:
6.6
3ko0S-2r2iA:
6.7
3ko0T-2r2iA:
6.6		 3ko0Q-2r2iA:
16.32
3ko0R-2r2iA:
16.32
3ko0S-2r2iA:
16.32
3ko0T-2r2iA:
16.32
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.
2v26 MYOSIN VI

(Sus scrofa) 		PF00063
(Myosin_head) 		5 PHE A 751
ASP A 748
LEU A 738
ILE A 769
PHE A 705
 None
 1.14A 3ko0Q-2v26A:
undetectable
3ko0R-2v26A:
1.4
3ko0S-2v26A:
1.5
3ko0T-2v26A:
undetectable		 3ko0Q-2v26A:
9.24
3ko0R-2v26A:
9.24
3ko0S-2v26A:
9.24
3ko0T-2v26A:
9.24
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.
2vca ALPHA-N-ACETYLGLUCOS
AMINIDASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C)
PF05089
(NAGLU)
PF12971
(NAGLU_N)
PF12972
(NAGLU_C) 		5 ASP A 854
PHE A 752
LEU A 760
SER A 756
PHE A 759
 None
 1.42A 3ko0Q-2vcaA:
undetectable
3ko0R-2vcaA:
0.0
3ko0S-2vcaA:
0.0
3ko0T-2vcaA:
undetectable		 3ko0Q-2vcaA:
8.00
3ko0R-2vcaA:
8.00
3ko0S-2vcaA:
8.00
3ko0T-2vcaA:
8.00
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.
2zai OLIGOSACCHARYL
TRANSFERASE STT3
SUBUNIT RELATED
PROTEIN

(Pyrococcus
furiosus) 		no annotation 5 ASP A 928
PHE A 869
GLU A 843
LEU A 918
ILE A 896
 None
 1.43A 3ko0Q-2zaiA:
undetectable
3ko0R-2zaiA:
undetectable
3ko0S-2zaiA:
undetectable
3ko0T-2zaiA:
undetectable		 3ko0Q-2zaiA:
10.47
3ko0R-2zaiA:
10.47
3ko0S-2zaiA:
10.47
3ko0T-2zaiA:
10.47
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.
2zqp PREPROTEIN
TRANSLOCASE SECY
SUBUNIT

(Thermus
thermophilus) 		PF00344
(SecY) 		5 SER Y  71
LEU Y  61
SER Y  63
PHE Y  62
ILE Y 192
 None
 1.43A 3ko0Q-2zqpY:
undetectable
3ko0R-2zqpY:
undetectable
3ko0S-2zqpY:
undetectable
3ko0T-2zqpY:
undetectable		 3ko0Q-2zqpY:
11.03
3ko0R-2zqpY:
11.03
3ko0S-2zqpY:
11.03
3ko0T-2zqpY:
11.03
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.
3cx6 GUANINE
NUCLEOTIDE-BINDING
PROTEIN ALPHA-13
SUBUNIT

(Mus musculus) 		PF00503
(G-alpha) 		5 PHE A 245
GLU A 251
LEU A 265
SER A 268
PHE A 289
 None
 1.30A 3ko0Q-3cx6A:
undetectable
3ko0R-3cx6A:
undetectable
3ko0S-3cx6A:
undetectable
3ko0T-3cx6A:
undetectable		 3ko0Q-3cx6A:
15.02
3ko0R-3cx6A:
15.02
3ko0S-3cx6A:
15.02
3ko0T-3cx6A:
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.
3eaf ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN

(Aeropyrum
pernix) 		PF13458
(Peripla_BP_6) 		5 ASP A 164
SER A 171
PHE A 410
ILE A 395
PHE A 298
 None
 1.23A 3ko0Q-3eafA:
undetectable
3ko0R-3eafA:
undetectable
3ko0S-3eafA:
undetectable
3ko0T-3eafA:
undetectable		 3ko0Q-3eafA:
12.92
3ko0R-3eafA:
12.92
3ko0S-3eafA:
12.92
3ko0T-3eafA:
12.92
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.
3n6n RNA-DEPENDENT RNA
POLYMERASE

(Enterovirus A) 		PF00680
(RdRP_1) 		5 ASP A  71
LEU A 241
SER A 242
PHE A 246
ILE A 301
 None
 1.47A 3ko0Q-3n6nA:
undetectable
3ko0R-3n6nA:
undetectable
3ko0S-3n6nA:
undetectable
3ko0T-3n6nA:
undetectable		 3ko0Q-3n6nA:
12.04
3ko0R-3n6nA:
12.04
3ko0S-3n6nA:
12.04
3ko0T-3n6nA:
12.04
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.
3oqv ALBC

(Streptomyces
noursei) 		PF16715
(CDPS) 		5 ASP A 205
LEU A 212
SER A 213
PHE A 211
ILE A 208
 None
None
None
None
DTD  A 248 ( 4.1A)
 1.25A 3ko0Q-3oqvA:
undetectable
3ko0R-3oqvA:
undetectable
3ko0S-3oqvA:
undetectable
3ko0T-3oqvA:
undetectable		 3ko0Q-3oqvA:
15.73
3ko0R-3oqvA:
15.73
3ko0S-3oqvA:
15.73
3ko0T-3oqvA:
15.73
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.
3rre PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermotoga
maritima) 		PF01256
(Carb_kinase)
PF03853
(YjeF_N) 		5 ASP A 344
LEU A 332
PHE A 331
ILE A 314
PHE A 293
 None
 1.33A 3ko0Q-3rreA:
undetectable
3ko0R-3rreA:
undetectable
3ko0S-3rreA:
undetectable
3ko0T-3rreA:
undetectable		 3ko0Q-3rreA:
11.38
3ko0R-3rreA:
11.38
3ko0S-3rreA:
11.38
3ko0T-3rreA:
11.38
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.
3tka RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE H

(Escherichia
coli) 		PF01795
(Methyltransf_5) 		5 ASP A 101
PHE A  79
GLU A 245
LEU A 216
ILE A 248
 SAM  A 400 (-3.6A)
SAM  A 400 (-3.2A)
None
None
None
 1.48A 3ko0Q-3tkaA:
undetectable
3ko0R-3tkaA:
undetectable
3ko0S-3tkaA:
undetectable
3ko0T-3tkaA:
undetectable		 3ko0Q-3tkaA:
15.21
3ko0R-3tkaA:
15.21
3ko0S-3tkaA:
15.21
3ko0T-3tkaA:
15.21
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.
3u9i MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
C-TERMINAL DOMAIN
PROTEIN

(Roseiflexus sp.
RS-1) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 SER A 318
GLU A  53
LEU A  17
ILE A  19
PHE A 338
 None
 1.44A 3ko0Q-3u9iA:
undetectable
3ko0R-3u9iA:
undetectable
3ko0S-3u9iA:
undetectable
3ko0T-3u9iA:
undetectable		 3ko0Q-3u9iA:
13.30
3ko0R-3u9iA:
13.30
3ko0S-3u9iA:
13.30
3ko0T-3u9iA:
13.30
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.
3wnp CYCLOISOMALTOOLIGOSA
CCHARIDE
GLUCANOTRANSFERASE

(Bacillus
circulans) 		PF13199
(Glyco_hydro_66)
PF16990
(CBM_35) 		5 ASP A 325
LEU A 334
PHE A 333
ILE A 236
PHE A 264
 None
 1.12A 3ko0Q-3wnpA:
undetectable
3ko0R-3wnpA:
undetectable
3ko0S-3wnpA:
undetectable
3ko0T-3wnpA:
undetectable		 3ko0Q-3wnpA:
9.04
3ko0R-3wnpA:
9.04
3ko0S-3wnpA:
9.04
3ko0T-3wnpA:
9.04
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.
3wry TM-1 PROTEIN

(Solanum
lycopersicum) 		PF06792
(UPF0261) 		5 ASP A 163
SER A 162
LEU A 107
ILE A  14
PHE A 167
 None
 1.43A 3ko0Q-3wryA:
undetectable
3ko0R-3wryA:
undetectable
3ko0S-3wryA:
undetectable
3ko0T-3wryA:
undetectable		 3ko0Q-3wryA:
12.53
3ko0R-3wryA:
12.53
3ko0S-3wryA:
12.53
3ko0T-3wryA:
12.53
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.
4anj UNCONVENTIONAL
MYOSIN-VI, GREEN
FLUORESCENT PROTEIN

(Aequorea
victoria;
Sus scrofa) 		PF00063
(Myosin_head)
PF01353
(GFP) 		5 PHE A 751
ASP A 748
LEU A 738
ILE A 769
PHE A 705
 None
 1.21A 3ko0Q-4anjA:
undetectable
3ko0R-4anjA:
undetectable
3ko0S-4anjA:
undetectable
3ko0T-4anjA:
undetectable		 3ko0Q-4anjA:
6.93
3ko0R-4anjA:
6.93
3ko0S-4anjA:
6.93
3ko0T-4anjA:
6.93
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.
4bc5 XYLULOSE KINASE

(Homo sapiens) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 SER A  63
PHE A  39
ASP A  14
LEU A  72
ILE A  75
 None
 1.43A 3ko0Q-4bc5A:
undetectable
3ko0R-4bc5A:
undetectable
3ko0S-4bc5A:
undetectable
3ko0T-4bc5A:
undetectable		 3ko0Q-4bc5A:
11.78
3ko0R-4bc5A:
11.78
3ko0S-4bc5A:
11.78
3ko0T-4bc5A:
11.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bhd SERINE
HYDROXYMETHYLTRANSFE
RASE

(Methanocaldococcus
jannaschii) 		PF00464
(SHMT) 		5 ASP A 351
ASP A 318
LEU A 332
PHE A 327
ILE A 325
 None
 1.16A 3ko0Q-4bhdA:
undetectable
3ko0R-4bhdA:
undetectable
3ko0S-4bhdA:
undetectable
3ko0T-4bhdA:
undetectable		 3ko0Q-4bhdA:
12.38
3ko0R-4bhdA:
12.38
3ko0S-4bhdA:
12.38
3ko0T-4bhdA:
12.38
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.
4bjp PENICILLIN BINDING
PROTEIN
TRANSPEPTIDASE
DOMAIN PROTEIN

(Escherichia
coli) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		5 ASP A 343
PHE A 417
LEU A 369
SER A 365
ILE A 336
 None
 1.33A 3ko0Q-4bjpA:
undetectable
3ko0R-4bjpA:
undetectable
3ko0S-4bjpA:
undetectable
3ko0T-4bjpA:
undetectable		 3ko0Q-4bjpA:
12.57
3ko0R-4bjpA:
12.57
3ko0S-4bjpA:
12.57
3ko0T-4bjpA:
12.57
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.
4bqn CAPSULAR
POLYSACCHARIDE
BIOSYNTHESIS PROTEIN

(Burkholderia
pseudomallei) 		no annotation 5 ASP A 173
SER A  79
ASP A 179
LEU A  19
ILE A 210
 None
 1.40A 3ko0Q-4bqnA:
undetectable
3ko0R-4bqnA:
undetectable
3ko0S-4bqnA:
undetectable
3ko0T-4bqnA:
undetectable		 3ko0Q-4bqnA:
17.38
3ko0R-4bqnA:
17.38
3ko0S-4bqnA:
17.38
3ko0T-4bqnA:
17.38
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.
4eco UNCHARACTERIZED
PROTEIN

(Bacteroides
eggerthii) 		no annotation 5 ASP A 421
PHE A 426
ASP A 676
LEU A 727
SER A 729
 None
 1.29A 3ko0Q-4ecoA:
undetectable
3ko0R-4ecoA:
undetectable
3ko0S-4ecoA:
undetectable
3ko0T-4ecoA:
undetectable		 3ko0Q-4ecoA:
11.07
3ko0R-4ecoA:
11.07
3ko0S-4ecoA:
11.07
3ko0T-4ecoA:
11.07
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.
4fid G PROTEIN ALPHA
SUBUNIT

(Entamoeba
histolytica) 		PF00503
(G-alpha) 		5 GLU A 214
LEU A 228
SER A 231
ILE A 288
PHE A 252
 None
 1.15A 3ko0Q-4fidA:
undetectable
3ko0R-4fidA:
undetectable
3ko0S-4fidA:
undetectable
3ko0T-4fidA:
undetectable		 3ko0Q-4fidA:
15.16
3ko0R-4fidA:
15.16
3ko0S-4fidA:
15.16
3ko0T-4fidA:
15.16
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.
4fid G PROTEIN ALPHA
SUBUNIT

(Entamoeba
histolytica) 		PF00503
(G-alpha) 		5 PHE A 208
GLU A 214
LEU A 228
SER A 231
PHE A 252
 None
 1.04A 3ko0Q-4fidA:
undetectable
3ko0R-4fidA:
undetectable
3ko0S-4fidA:
undetectable
3ko0T-4fidA:
undetectable		 3ko0Q-4fidA:
15.16
3ko0R-4fidA:
15.16
3ko0S-4fidA:
15.16
3ko0T-4fidA:
15.16
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.
4hwt THREONINE--TRNA
LIGASE, CYTOPLASMIC

(Homo sapiens) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon) 		5 ASP A 495
LEU A 596
ILE A 509
CYH A 512
PHE A 515
 1B2  A 802 (-3.6A)
None
None
None
None
 1.22A 3ko0Q-4hwtA:
undetectable
3ko0R-4hwtA:
1.1
3ko0S-4hwtA:
1.0
3ko0T-4hwtA:
1.1		 3ko0Q-4hwtA:
14.49
3ko0R-4hwtA:
14.49
3ko0S-4hwtA:
14.49
3ko0T-4hwtA:
14.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i5j SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
REGULATORY SUBUNIT
B'' SUBUNIT ALPHA

(Homo sapiens) 		PF13499
(EF-hand_7) 		5 SER A 346
PHE A 343
ILE A 318
CYH A 362
PHE A 360
 None
 1.35A 3ko0Q-4i5jA:
3.0
3ko0R-4i5jA:
2.9
3ko0S-4i5jA:
2.9
3ko0T-4i5jA:
2.7		 3ko0Q-4i5jA:
17.96
3ko0R-4i5jA:
17.96
3ko0S-4i5jA:
17.96
3ko0T-4i5jA:
17.96
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.
4ktp GLYCOSIDE HYDROLASE
FAMILY 65 CENTRAL
CATALYTIC

([Bacillus]
selenitireducens) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		5 SER A 383
GLU A 336
ASP A 419
LEU A 355
PHE A 451
 None
 1.41A 3ko0Q-4ktpA:
undetectable
3ko0R-4ktpA:
undetectable
3ko0S-4ktpA:
undetectable
3ko0T-4ktpA:
undetectable		 3ko0Q-4ktpA:
7.74
3ko0R-4ktpA:
7.74
3ko0S-4ktpA:
7.74
3ko0T-4ktpA:
7.74
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.
4mew SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
REGULATORY SUBUNIT
B'' SUBUNIT BETA

(Homo sapiens) 		PF13499
(EF-hand_7) 		5 SER A 383
PHE A 380
ILE A 355
CYH A 399
PHE A 397
 None
 1.30A 3ko0Q-4mewA:
3.2
3ko0R-4mewA:
4.5
3ko0S-4mewA:
4.4
3ko0T-4mewA:
4.2		 3ko0Q-4mewA:
12.64
3ko0R-4mewA:
12.64
3ko0S-4mewA:
12.64
3ko0T-4mewA:
12.64
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.
4n5a PROTEIN EFR3

(Saccharomyces
cerevisiae) 		no annotation 5 SER A 182
LEU A 270
SER A 266
ILE A 199
PHE A 155
 None
 1.49A 3ko0Q-4n5aA:
undetectable
3ko0R-4n5aA:
1.6
3ko0S-4n5aA:
1.6
3ko0T-4n5aA:
undetectable		 3ko0Q-4n5aA:
11.95
3ko0R-4n5aA:
11.95
3ko0S-4n5aA:
11.95
3ko0T-4n5aA:
11.95
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.
4ojz PUTATIVE ALGINATE
LYASE

(Saccharophagus
degradans) 		PF05426
(Alginate_lyase)
PF07940
(Hepar_II_III) 		5 SER A 189
LEU A 227
SER A 226
PHE A 238
ILE A 273
 None
 1.36A 3ko0Q-4ojzA:
undetectable
3ko0R-4ojzA:
undetectable
3ko0S-4ojzA:
0.0
3ko0T-4ojzA:
undetectable		 3ko0Q-4ojzA:
8.97
3ko0R-4ojzA:
8.97
3ko0S-4ojzA:
8.97
3ko0T-4ojzA:
8.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p7l POLY-BETA-1,6-N-ACET
YL-D-GLUCOSAMINE
N-DEACETYLASE

(Escherichia
coli) 		PF14883
(GHL13) 		5 ASP A 466
PHE A 553
GLU A 576
ILE A 545
PHE A 560
 None
 1.31A 3ko0Q-4p7lA:
undetectable
3ko0R-4p7lA:
undetectable
3ko0S-4p7lA:
undetectable
3ko0T-4p7lA:
undetectable		 3ko0Q-4p7lA:
15.25
3ko0R-4p7lA:
15.25
3ko0S-4p7lA:
15.25
3ko0T-4p7lA:
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.
4pwy CALMODULIN-LYSINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF10294
(Methyltransf_16) 		5 PHE A  65
GLU A 132
LEU A  70
SER A  67
ILE A 292
 UNX  A 408 ( 4.8A)
UNX  A 420 ( 3.3A)
None
UNX  A 420 ( 3.0A)
None
 1.22A 3ko0Q-4pwyA:
undetectable
3ko0R-4pwyA:
undetectable
3ko0S-4pwyA:
undetectable
3ko0T-4pwyA:
undetectable		 3ko0Q-4pwyA:
18.85
3ko0R-4pwyA:
18.85
3ko0S-4pwyA:
18.85
3ko0T-4pwyA:
18.85
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.
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) 		5 ASP A2537
GLU A2530
LEU A2506
ILE A2526
PHE A2572
 None
 1.41A 3ko0Q-4rh7A:
undetectable
3ko0R-4rh7A:
undetectable
3ko0S-4rh7A:
undetectable
3ko0T-4rh7A:
undetectable		 3ko0Q-4rh7A:
2.91
3ko0R-4rh7A:
2.91
3ko0S-4rh7A:
2.91
3ko0T-4rh7A:
2.91
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.
4u3t PENICILLIN-BINDING
PROTEIN 2

(Neisseria
gonorrhoeae) 		PF00905
(Transpeptidase) 		5 ASP A 346
SER A 363
PHE A 420
SER A 368
ILE A 413
 None
 1.15A 3ko0Q-4u3tA:
undetectable
3ko0R-4u3tA:
undetectable
3ko0S-4u3tA:
undetectable
3ko0T-4u3tA:
undetectable		 3ko0Q-4u3tA:
15.76
3ko0R-4u3tA:
15.76
3ko0S-4u3tA:
15.76
3ko0T-4u3tA:
15.76
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.
4wzz PUTATIVE SUGAR ABC
TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF13407
(Peripla_BP_4) 		5 ASP A 169
GLU A 356
ASP A 281
PHE A 355
ILE A 360
 None
None
None
EDO  A 403 ( 4.8A)
None
 1.32A 3ko0Q-4wzzA:
undetectable
3ko0R-4wzzA:
undetectable
3ko0S-4wzzA:
undetectable
3ko0T-4wzzA:
undetectable		 3ko0Q-4wzzA:
13.01
3ko0R-4wzzA:
13.01
3ko0S-4wzzA:
13.01
3ko0T-4wzzA:
13.01
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.
4yzg PROTEIN PHOSPHATASE
2C 57

(Arabidopsis
thaliana) 		PF00481
(PP2C) 		5 ASP A 296
ASP A  74
LEU A 333
SER A 337
PHE A  68
 MN  A 402 (-2.6A)
MN  A 402 ( 4.8A)
None
None
None
 1.38A 3ko0Q-4yzgA:
undetectable
3ko0R-4yzgA:
undetectable
3ko0S-4yzgA:
undetectable
3ko0T-4yzgA:
undetectable		 3ko0Q-4yzgA:
18.77
3ko0R-4yzgA:
18.77
3ko0S-4yzgA:
18.77
3ko0T-4yzgA:
18.77
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.
5cm2 TRNA
METHYLTRANSFERASE
ACTIVATOR SUBUNIT

(Yarrowia
lipolytica) 		PF03966
(Trm112p) 		5 PHE M  23
LEU M   4
SER M   6
PHE M   8
ILE M  51
 None
 1.19A 3ko0Q-5cm2M:
undetectable
3ko0R-5cm2M:
undetectable
3ko0S-5cm2M:
undetectable
3ko0T-5cm2M:
undetectable		 3ko0Q-5cm2M:
27.61
3ko0R-5cm2M:
27.61
3ko0S-5cm2M:
27.61
3ko0T-5cm2M:
27.61
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.
5cyk RIBOSOME BIOGENESIS
PROTEIN YTM1

(Chaetomium
thermophilum) 		PF00400
(WD40)
PF08154
(NLE) 		5 ASP A 417
SER A 403
GLU A  23
LEU A  26
ILE A  61
 None
 1.25A 3ko0Q-5cykA:
undetectable
3ko0R-5cykA:
undetectable
3ko0S-5cykA:
undetectable
3ko0T-5cykA:
undetectable		 3ko0Q-5cykA:
10.91
3ko0R-5cykA:
10.91
3ko0S-5cykA:
10.91
3ko0T-5cykA:
10.91
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.
5d4k POLYMERIC
IMMUNOGLOBULIN
RECEPTOR

(Homo sapiens) 		PF07686
(V-set) 		5 ASP A 312
SER A 311
PHE A 251
LEU A 126
SER A 319
 None
 1.38A 3ko0Q-5d4kA:
undetectable
3ko0R-5d4kA:
undetectable
3ko0S-5d4kA:
undetectable
3ko0T-5d4kA:
undetectable		 3ko0Q-5d4kA:
8.94
3ko0R-5d4kA:
8.94
3ko0S-5d4kA:
8.94
3ko0T-5d4kA:
8.94
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.
5e1b N-TERMINAL
XAA-PRO-LYS
N-METHYLTRANSFERASE
1

(Homo sapiens) 		PF05891
(Methyltransf_PK) 		5 SER A  38
ASP A  67
LEU A  49
SER A  45
PHE A  48
 None
 1.20A 3ko0Q-5e1bA:
undetectable
3ko0R-5e1bA:
undetectable
3ko0S-5e1bA:
undetectable
3ko0T-5e1bA:
undetectable		 3ko0Q-5e1bA:
20.08
3ko0R-5e1bA:
20.08
3ko0S-5e1bA:
20.08
3ko0T-5e1bA:
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.
5hyh UNCHARACTERIZED
PROTEIN

(Streptomyces
venezuelae) 		PF11583
(AurF) 		5 SER A 164
LEU A  94
SER A  95
PHE A  69
ILE A  74
 None
 1.18A 3ko0Q-5hyhA:
undetectable
3ko0R-5hyhA:
undetectable
3ko0S-5hyhA:
undetectable
3ko0T-5hyhA:
undetectable		 3ko0Q-5hyhA:
14.19
3ko0R-5hyhA:
14.19
3ko0S-5hyhA:
14.19
3ko0T-5hyhA:
14.19
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.
5ioj HALOALKYLPHOSPHORUS
HYDROLASE

(Sphingobium sp.
TCM1) 		no annotation 5 ASP A 289
SER A 291
GLU A 325
SER A 263
ILE A 328
 None
 1.48A 3ko0Q-5iojA:
undetectable
3ko0R-5iojA:
undetectable
3ko0S-5iojA:
undetectable
3ko0T-5iojA:
undetectable		 3ko0Q-5iojA:
10.29
3ko0R-5iojA:
10.29
3ko0S-5iojA:
10.29
3ko0T-5iojA:
10.29
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.
5k04 UNCHARACTERIZED
PROTEIN

(Candida
albicans) 		PF09797
(NatB_MDM20) 		5 GLU A  94
SER A  90
ILE A  97
CYH A 108
PHE A 112
 None
 1.29A 3ko0Q-5k04A:
1.7
3ko0R-5k04A:
undetectable
3ko0S-5k04A:
undetectable
3ko0T-5k04A:
undetectable		 3ko0Q-5k04A:
9.64
3ko0R-5k04A:
9.64
3ko0S-5k04A:
9.64
3ko0T-5k04A:
9.64
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.
5ksh PENICILLIN-BINDING
PROTEIN 2

(Neisseria
gonorrhoeae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		5 ASP A 346
SER A 363
PHE A 420
SER A 368
ILE A 413
 None
 1.17A 3ko0Q-5kshA:
undetectable
3ko0R-5kshA:
undetectable
3ko0S-5kshA:
undetectable
3ko0T-5kshA:
undetectable		 3ko0Q-5kshA:
10.70
3ko0R-5kshA:
10.70
3ko0S-5kshA:
10.70
3ko0T-5kshA:
10.70
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.
5liy ALDO-KETO REDUCTASE
FAMILY 1 MEMBER B10

(Homo sapiens) 		PF00248
(Aldo_ket_red) 		5 GLU X  85
ASP X 140
LEU X  88
SER X 118
PHE X  83
 None
 1.45A 3ko0Q-5liyX:
undetectable
3ko0R-5liyX:
undetectable
3ko0S-5liyX:
undetectable
3ko0T-5liyX:
undetectable		 3ko0Q-5liyX:
15.61
3ko0R-5liyX:
15.61
3ko0S-5liyX:
15.61
3ko0T-5liyX:
15.61
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.
5lnb UBIQUITIN-LIKE-SPECI
FIC PROTEASE 2

(Saccharomyces
cerevisiae) 		PF02902
(Peptidase_C48) 		5 ASP B  59
LEU B  91
PHE B 185
ILE B 182
CYH B 130
 None
 1.41A 3ko0Q-5lnbB:
undetectable
3ko0R-5lnbB:
undetectable
3ko0S-5lnbB:
undetectable
3ko0T-5lnbB:
undetectable		 3ko0Q-5lnbB:
16.50
3ko0R-5lnbB:
16.50
3ko0S-5lnbB:
16.50
3ko0T-5lnbB:
16.50
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.
5mpm SARCOPLASMIC/ENDOPLA
SMIC RETICULUM
CALCIUM ATPASE 2

(Sus scrofa) 		no annotation 5 ASP A 799
SER A 766
GLU A 309
LEU A  65
ILE A  94
 None
None
None
CZA  A1002 (-4.1A)
None
 1.33A 3ko0Q-5mpmA:
undetectable
3ko0R-5mpmA:
undetectable
3ko0S-5mpmA:
undetectable
3ko0T-5mpmA:
undetectable		 3ko0Q-5mpmA:
24.47
3ko0R-5mpmA:
24.47
3ko0S-5mpmA:
24.47
3ko0T-5mpmA:
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.
5n6m APOLIPOPROTEIN
N-ACYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00795
(CN_hydrolase) 		5 SER A 153
GLU A 135
LEU A 132
SER A 172
PHE A 173
 None
 1.31A 3ko0Q-5n6mA:
1.7
3ko0R-5n6mA:
1.5
3ko0S-5n6mA:
1.4
3ko0T-5n6mA:
1.6		 3ko0Q-5n6mA:
10.32
3ko0R-5n6mA:
10.32
3ko0S-5n6mA:
10.32
3ko0T-5n6mA:
10.32
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.
5osb PROTON-GATED ION
CHANNEL,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT
ALPHA-1,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-1

(Gloeobacter
violaceus;
Mus musculus) 		no annotation 5 SER A 240
PHE A 295
LEU A 401
ILE A 405
PHE A 288
 None
 1.47A 3ko0Q-5osbA:
1.9
3ko0R-5osbA:
undetectable
3ko0S-5osbA:
1.5
3ko0T-5osbA:
undetectable		 3ko0Q-5osbA:
15.94
3ko0R-5osbA:
15.94
3ko0S-5osbA:
15.94
3ko0T-5osbA:
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.
5uv2 (+)-LIMONENE
SYNTHASE

(Citrus sinensis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 ASP A 262
ASP A 103
LEU A 111
PHE A 120
ILE A  95
 None
 1.48A 3ko0Q-5uv2A:
undetectable
3ko0R-5uv2A:
0.5
3ko0S-5uv2A:
undetectable
3ko0T-5uv2A:
undetectable		 3ko0Q-5uv2A:
11.99
3ko0R-5uv2A:
11.99
3ko0S-5uv2A:
11.99
3ko0T-5uv2A:
11.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v07 EXONUCLEASE 1

(Homo sapiens) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		5 SER Z 222
PHE Z 215
ASP Z 171
LEU Z   7
ILE Z 195
 None
None
MN  Z 401 (-2.7A)
None
None
 1.32A 3ko0Q-5v07Z:
undetectable
3ko0R-5v07Z:
undetectable
3ko0S-5v07Z:
undetectable
3ko0T-5v07Z:
undetectable		 3ko0Q-5v07Z:
14.45
3ko0R-5v07Z:
14.45
3ko0S-5v07Z:
14.45
3ko0T-5v07Z:
14.45
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.
5xbl CRISPR-ASSOCIATED
ENDONUCLEASE
CAS9/CSN1

(Streptococcus
pyogenes) 		PF13395
(HNH_4)
PF16592
(Cas9_REC)
PF16593
(Cas9-BH)
PF16595
(Cas9_PI) 		5 GLU A 617
ASP A 618
LEU A 513
SER A 512
PHE A 626
 None
 1.17A 3ko0Q-5xblA:
undetectable
3ko0R-5xblA:
undetectable
3ko0S-5xblA:
undetectable
3ko0T-5xblA:
undetectable		 3ko0Q-5xblA:
5.97
3ko0R-5xblA:
5.97
3ko0S-5xblA:
5.97
3ko0T-5xblA:
5.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y5a KLLA0F20702P

(Kluyveromyces
lactis) 		no annotation 5 ASP A 226
PHE A 239
LEU A 521
PHE A 524
ILE A 367
 None
 1.35A 3ko0Q-5y5aA:
undetectable
3ko0R-5y5aA:
undetectable
3ko0S-5y5aA:
undetectable
3ko0T-5y5aA:
1.2		 3ko0Q-5y5aA:
19.80
3ko0R-5y5aA:
19.80
3ko0S-5y5aA:
19.80
3ko0T-5y5aA:
19.80
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.
6d6u GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
ALPHA-1,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-1

(Homo sapiens) 		no annotation 5 SER B 241
PHE B 296
LEU B 331
ILE B 335
PHE B 289
 None
 1.36A 3ko0Q-6d6uB:
1.9
3ko0R-6d6uB:
undetectable
3ko0S-6d6uB:
undetectable
3ko0T-6d6uB:
1.8		 3ko0Q-6d6uB:
20.39
3ko0R-6d6uB:
20.39
3ko0S-6d6uB:
20.39
3ko0T-6d6uB:
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.
6d6u GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
BETA-2,GAMMA-AMINOBU
TYRIC ACID RECEPTOR
SUBUNIT BETA-2
GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
GAMMA-2,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT GAMMA-2

(Homo sapiens) 		no annotation 5 ASP A  48
SER A  46
LEU E 167
PHE E 113
ILE E 147
 None
 1.12A 3ko0Q-6d6uA:
1.9
3ko0R-6d6uA:
1.8
3ko0S-6d6uA:
undetectable
3ko0T-6d6uA:
1.8		 3ko0Q-6d6uA:
19.80
3ko0R-6d6uA:
19.80
3ko0S-6d6uA:
19.80
3ko0T-6d6uA:
19.80
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.
6dw1

() 		no annotation 5 ASP E  48
SER E  46
LEU D 167
PHE D 113
ILE D 147
 None
 1.23A 3ko0Q-6dw1E:
undetectable
3ko0R-6dw1E:
undetectable
3ko0S-6dw1E:
undetectable
3ko0T-6dw1E:
undetectable		 3ko0Q-6dw1E:
undetectable
3ko0R-6dw1E:
undetectable
3ko0S-6dw1E:
undetectable
3ko0T-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.
6evj RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza A
virus) 		no annotation 5 ASP B 112
LEU B 102
PHE B 103
ILE B 262
PHE B 254
 None
 1.02A 3ko0Q-6evjB:
undetectable
3ko0R-6evjB:
undetectable
3ko0S-6evjB:
undetectable
3ko0T-6evjB:
undetectable		 3ko0Q-6evjB:
17.92
3ko0R-6evjB:
17.92
3ko0S-6evjB:
17.92
3ko0T-6evjB:
17.92