SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4yu5'

List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
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.
1HXB_A_ROCA100_4
(HIV-1 PROTEASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 4 GLY A 693
ASP A 683
GLY A 687
THR A 718
None
1.02A 1hxbB-4yu5A:
undetectable
1hxbB-4yu5A:
9.12
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.
1JHY_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 9 THR A 718
GLY A 399
SER A 409
GLU A 403
GLY A 696
None
1.34A 1jhyA-4yu5A:
undetectable
1jhyA-4yu5A:
18.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L4N_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 9 THR A 718
GLY A 399
SER A 409
GLU A 403
GLY A 696
None
1.31A 1l4nA-4yu5A:
undetectable
1l4nA-4yu5A:
18.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L5K_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 9 THR A 718
GLY A 399
SER A 409
GLU A 403
GLY A 696
None
1.30A 1l5kA-4yu5A:
undetectable
1l5kA-4yu5A:
18.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L5L_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 9 THR A 718
GLY A 399
SER A 409
GLU A 403
GLY A 696
None
1.29A 1l5lA-4yu5A:
undetectable
1l5lA-4yu5A:
18.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L5M_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 9 THR A 718
GLY A 399
SER A 409
GLU A 403
GLY A 696
None
1.28A 1l5mA-4yu5A:
undetectable
1l5mA-4yu5A:
18.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MIC_A_DVAA6_0
(GRAMICIDIN A)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 ALA A 404
VAL A 402
TRP A 675
None
0.90A 1micA-4yu5A:
undetectable
1micB-4yu5A:
undetectable
1micA-4yu5A:
1.95
1micB-4yu5A:
1.95
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.
1Q23_E_FUAE706_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 10 PHE A 756
SER A 700
LEU A 672
VAL A 795
VAL A 674
None
1.27A 1q23E-4yu5A:
undetectable
1q23E-4yu5A:
14.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Q23_F_FUAF704_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 11 PHE A 756
SER A 700
LEU A 672
VAL A 795
VAL A 674
None
1.32A 1q23F-4yu5A:
undetectable
1q23F-4yu5A:
14.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1X8V_A_ESLA471_1
(CYTOCHROME P450 51)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 8 PHE A 193
ARG A  56
ALA A 373
LEU A 210
None
1.12A 1x8vA-4yu5A:
undetectable
1x8vA-4yu5A:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FB2_B_SAMB501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 7 THR A 423
GLU A 225
SER A 465
VAL A 474
None
1.22A 2fb2B-4yu5A:
undetectable
2fb2B-4yu5A:
17.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FXD_A_DR7A102_2
(POL PROTEIN)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 7 ASP A 329
ASP A 259
GLY A  89
ILE A  84
None
CA  A1004 (-3.3A)
None
None
0.93A 2fxdB-4yu5A:
undetectable
2fxdB-4yu5A:
8.47
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.
2OXT_C_SAMC300_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 4 SER A 230
GLY A 439
HIS A 310
ASP A 288
None
None
None
CA  A1003 (-3.5A)
1.34A 2oxtC-4yu5A:
undetectable
2oxtC-4yu5A:
18.44
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.
2VMY_A_GLYA502_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 7 SER A 337
HIS A 258
HIS A 335
ARG A 267
None
1.31A 2vmyA-4yu5A:
undetectable
2vmyB-4yu5A:
undetectable
2vmyA-4yu5A:
20.16
2vmyB-4yu5A:
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.
2VMY_B_GLYB502_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 8 SER A 337
HIS A 258
HIS A 335
ARG A 267
None
1.32A 2vmyA-4yu5A:
undetectable
2vmyB-4yu5A:
undetectable
2vmyA-4yu5A:
20.16
2vmyB-4yu5A:
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.
2VOU_A_ACTA1397_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 PRO A 666
GLY A 719
TYR A 668
None
0.62A 2vouA-4yu5A:
undetectable
2vouA-4yu5A:
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.
2VOU_B_ACTB1391_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 PRO A 666
GLY A 719
TYR A 668
None
0.59A 2vouB-4yu5A:
undetectable
2vouB-4yu5A:
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.
2VOU_C_ACTC1391_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 PRO A 666
GLY A 719
TYR A 668
None
0.57A 2vouC-4yu5A:
undetectable
2vouC-4yu5A:
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.
2VQY_A_PARA1201_1
(AAC(6')-IB)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 12 GLY A 257
LEU A  57
GLU A 321
ASP A 329
ASP A 259
None
None
None
None
CA  A1004 (-3.3A)
1.41A 2vqyA-4yu5A:
undetectable
2vqyA-4yu5A:
13.53
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.
2X45_A_HSMA1161_1
(ALLERGEN ARG R 1)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 5 VAL A 674
TYR A 646
VAL A 774
ASP A 758
None
1.22A 2x45A-4yu5A:
undetectable
2x45A-4yu5A:
11.47
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.
3FI0_O_TRPO1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 9 ASP A 463
ILE A 462
VAL A 795
VAL A 783
GLN A 786
None
1.36A 3fi0O-4yu5A:
undetectable
3fi0O-4yu5A:
17.41
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.
3MTE_A_SAMA220_0
(16S RRNA METHYLASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
6 / 12 GLY A 691
GLY A 693
PRO A 401
ASN A 684
ALA A 770
SER A 680
None
1.33A 3mteA-4yu5A:
undetectable
3mteA-4yu5A:
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.
3P2K_A_SAMA6735_0
(16S RRNA METHYLASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
6 / 12 GLY A 693
PRO A 690
ALA A 768
ALA A 770
LEU A 695
THR A 398
None
1.43A 3p2kA-4yu5A:
undetectable
3p2kA-4yu5A:
15.87
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.
3P2K_D_SAMD6735_0
(16S RRNA METHYLASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 12 GLY A 691
GLY A 693
PRO A 401
ALA A 770
SER A 680
None
1.01A 3p2kD-4yu5A:
undetectable
3p2kD-4yu5A:
15.87
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.
3R24_A_SAMA302_0
(2'-O-METHYL
TRANSFERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 12 GLY A 411
SER A 424
GLY A 659
ASN A 429
ASP A 389
None
None
None
None
ZN  A1001 (-2.4A)
1.12A 3r24A-4yu5A:
undetectable
3r24A-4yu5A:
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.
3RC0_A_SAMA484_0
(N-LYSINE
METHYLTRANSFERASE
SETD6)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 11 VAL A 795
ALA A 794
GLY A 785
ALA A 152
LEU A 648
None
KH2  A1006 (-3.7A)
None
None
None
1.18A 3rc0A-4yu5A:
undetectable
3rc0A-4yu5A:
19.50
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.
3RC0_B_SAMB480_0
(N-LYSINE
METHYLTRANSFERASE
SETD6)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 12 VAL A 795
ALA A 794
GLY A 785
ALA A 152
LEU A 648
None
KH2  A1006 (-3.7A)
None
None
None
1.18A 3rc0B-4yu5A:
undetectable
3rc0B-4yu5A:
19.50
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.
3T3S_E_9PLE1_1
(CYTOCHROME P450 2A13)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 8 ALA A 770
PHE A 745
PHE A 705
THR A 714
None
1.07A 3t3sE-4yu5A:
undetectable
3t3sE-4yu5A:
21.29
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.
3U9F_I_CLMI221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 10 PHE A 756
SER A 700
LEU A 672
VAL A 795
VAL A 674
None
1.32A 3u9fI-4yu5A:
undetectable
3u9fI-4yu5A:
14.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U9F_J_CLMJ221_0
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 12 PHE A 756
SER A 700
LEU A 672
VAL A 795
VAL A 674
None
1.33A 3u9fJ-4yu5A:
undetectable
3u9fK-4yu5A:
undetectable
3u9fJ-4yu5A:
14.31
3u9fK-4yu5A:
14.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U9F_R_CLMR221_0
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 10 PHE A 756
SER A 700
LEU A 672
VAL A 795
VAL A 674
None
1.33A 3u9fR-4yu5A:
undetectable
3u9fR-4yu5A:
14.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LL3_A_017A202_2
(PROTEASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 9 ASP A 259
ASP A 330
GLY A 323
PRO A 369
ILE A 332
CA  A1004 (-3.3A)
None
None
None
None
1.21A 4ll3B-4yu5A:
undetectable
4ll3B-4yu5A:
8.72
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.
4P65_A_IPHA101_0
(INSULIN)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 10 LEU A 169
HIS A 275
LEU A 274
ALA A 277
LEU A 241
None
1.18A 4p65A-4yu5A:
undetectable
4p65B-4yu5A:
undetectable
4p65F-4yu5A:
undetectable
4p65H-4yu5A:
undetectable
4p65A-4yu5A:
2.58
4p65B-4yu5A:
3.94
4p65F-4yu5A:
3.94
4p65H-4yu5A:
3.94
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.
4P65_C_IPHC101_0
(INSULIN)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 11 LEU A 169
HIS A 275
LEU A 274
ALA A 277
LEU A 241
None
1.13A 4p65C-4yu5A:
undetectable
4p65D-4yu5A:
undetectable
4p65J-4yu5A:
undetectable
4p65L-4yu5A:
undetectable
4p65C-4yu5A:
2.58
4p65D-4yu5A:
3.94
4p65J-4yu5A:
3.94
4p65L-4yu5A:
3.94
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.
4P65_E_IPHE101_0
(INSULIN)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 11 LEU A 169
HIS A 275
LEU A 274
ALA A 277
LEU A 241
None
1.07A 4p65E-4yu5A:
undetectable
4p65F-4yu5A:
undetectable
4p65J-4yu5A:
undetectable
4p65L-4yu5A:
undetectable
4p65E-4yu5A:
2.58
4p65F-4yu5A:
3.94
4p65J-4yu5A:
3.94
4p65L-4yu5A:
3.94
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.
4P65_G_IPHG101_0
(INSULIN)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 11 LEU A 241
LEU A 169
HIS A 275
LEU A 274
ALA A 277
None
1.09A 4p65B-4yu5A:
undetectable
4p65D-4yu5A:
undetectable
4p65G-4yu5A:
undetectable
4p65H-4yu5A:
undetectable
4p65B-4yu5A:
3.94
4p65D-4yu5A:
3.94
4p65G-4yu5A:
2.58
4p65H-4yu5A:
3.94
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.
5A1R_A_STRA600_1
(CYTOCHROME P450 3A4)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 5 PHE A 381
PHE A 203
PHE A 219
VAL A 166
None
1.20A 5a1rA-4yu5A:
undetectable
5a1rA-4yu5A:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5C0O_G_SAMG301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 12 ALA A  60
GLY A 319
GLY A 323
GLY A 328
LEU A 327
None
0.97A 5c0oG-4yu5A:
undetectable
5c0oG-4yu5A:
15.78
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.
5GQB_A_GCSA602_1
(CHITINASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 TRP A 405
GLU A 649
ASP A 657
None
0.94A 5gqbA-4yu5A:
undetectable
5gqbA-4yu5A:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKR_A_ID8A601_2
(PROSTAGLANDIN G/H
SYNTHASE 2)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 VAL A 673
LEU A 387
MET A 408
None
0.87A 5ikrA-4yu5A:
undetectable
5ikrA-4yu5A:
19.66
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.
5JGL_A_SAMA301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 GLY A 397
ASP A 769
ASN A 764
None
0.51A 5jglA-4yu5A:
undetectable
5jglA-4yu5A:
17.57
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.
5N5D_A_SAMA306_0
(METHYLTRANSFERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 12 ALA A 704
GLY A 719
TYR A 715
ALA A 404
ALA A 723
None
1.05A 5n5dA-4yu5A:
undetectable
5n5dA-4yu5A:
16.78
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.
5OV9_B_CVIB602_0
(ACETYLCHOLINESTERASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 8 ASP A 758
LEU A 777
VAL A 477
TYR A 646
None
1.13A 5ov9B-4yu5A:
undetectable
5ov9B-4yu5A:
21.23
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.
5Y2T_A_8LXA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 SER A 190
HIS A 197
TYR A 208
None
0.92A 5y2tA-4yu5A:
undetectable
5y2tA-4yu5A:
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.
5Z6K_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 MET A 437
ASP A 164
ARG A 292
None
1.21A 5z6kA-4yu5A:
undetectable
5z6kA-4yu5A:
11.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6A5Y_D_9CRD501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
3 / 3 ASN A 764
VAL A 753
HIS A 701
None
0.87A 6a5yD-4yu5A:
undetectable
6a5yD-4yu5A:
7.34
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.
6AG0_C_ACRC607_0
(ALPHA-AMYLASE)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
4 / 6 GLY A 317
ASP A 182
GLY A 319
GLY A 323
None
0.77A 6ag0C-4yu5A:
undetectable
6ag0C-4yu5A:
7.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DWN_B_AQ4B602_1
(CYTOCHROME P450 1A1)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 7 SER A 334
PHE A 377
GLY A 317
ALA A 316
LEU A 170
None
1.42A 6dwnB-4yu5A:
undetectable
6dwnB-4yu5A:
8.04
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.
6DWN_D_AQ4D602_0
(CYTOCHROME P450 1A1)
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus
cereus)
5 / 12 ILE A 181
PHE A 193
GLY A 372
ALA A 373
PHE A 377
None
1.11A 6dwnD-4yu5A:
undetectable
6dwnD-4yu5A:
8.04