SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4iru'

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.
1BDW_A_DVAA6_0
(GRAMICIDIN A)		 4iru LEPB
(Legionella
pneumophila) 		3 / 3 ALA A 463
VAL A 465
TRP A 464
 None
 0.86A 1bdwA-4iruA:
undetectable
1bdwB-4iruA:
undetectable		 1bdwA-4iruA:
4.88
1bdwB-4iruA:
4.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ADS_B_IMNB3_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 4iru LEPB
(Legionella
pneumophila) 		5 / 12 ILE A 478
GLY A 476
ALA A 513
LEU A 381
VAL A 378
 None
None
None
K  A 912 ( 4.9A)
None
 1.30A 3adsB-4iruA:
undetectable		 3adsB-4iruA:
24.01
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.
3EIG_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 4iru LEPB
(Legionella
pneumophila) 		5 / 12 ILE A 584
ALA A 587
GLU A 561
ASN A 563
LEU A 562
 None
None
None
GOL  A 905 ( 4.4A)
K  A 911 (-4.8A)
 1.38A 3eigA-4iruA:
undetectable		 3eigA-4iruA:
17.92
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.
3ITA_D_AICD501_1
(D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACC)		 4iru LEPB
(Legionella
pneumophila) 		3 / 3 PRO A 529
PHE A 526
ALA A 392
 None
 0.62A 3itaD-4iruA:
undetectable		 3itaD-4iruA:
24.72
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.
3OWX_A_XRAA233_2
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4iru LEPB
(Legionella
pneumophila) 		4 / 5 VAL A 378
PHE A 510
ILE A 477
PHE A 507
 None
 0.99A 3owxB-4iruA:
undetectable		 3owxB-4iruA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OZV_B_ECNB411_1
(FLAVOHEMOGLOBIN)		 4iru LEPB
(Legionella
pneumophila) 		5 / 9 ILE A 517
ILE A 467
ALA A 382
LEU A 381
ALA A 513
 None
None
None
K  A 912 ( 4.9A)
None
 1.03A 3ozvB-4iruA:
2.0		 3ozvB-4iruA:
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.
3TPX_E_ACTE204_0
(E3 UBIQUITIN-PROTEIN
LIGASE MDM2)		 4iru LEPB
(Legionella
pneumophila) 		3 / 3 LYS A 327
PRO A 328
LEU A 329
 None
 0.84A 3tpxE-4iruA:
undetectable		 3tpxE-4iruA:
14.29
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.
3W9T_B_W9TB513_1
(HEMOLYTIC LECTIN
CEL-III)		 4iru LEPB
(Legionella
pneumophila) 		4 / 6 THR A 434
ASN A 375
ASP A 379
ILE A 383
 None
 1.27A 3w9tB-4iruA:
undetectable		 3w9tB-4iruA:
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.
4J24_C_ESTC600_1
(ESTROGEN RECEPTOR
BETA)		 4iru LEPB
(Legionella
pneumophila) 		5 / 12 LEU A 376
GLU A 380
ILE A 478
ILE A 477
LEU A 471
 None
 1.29A 4j24C-4iruA:
undetectable		 4j24C-4iruA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4J26_B_ESTB600_1
(ESTROGEN RECEPTOR
BETA)		 4iru LEPB
(Legionella
pneumophila) 		5 / 12 LEU A 376
GLU A 380
ILE A 478
ILE A 477
LEU A 471
 None
 1.31A 4j26B-4iruA:
undetectable		 4j26B-4iruA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LTW_A_486A302_1
(ANCESTRAL STEROID
RECEPTOR 2)		 4iru LEPB
(Legionella
pneumophila) 		5 / 12 LEU A 521
ILE A 467
GLU A 514
ILE A 517
ALA A 513
 None
 1.04A 4ltwA-4iruA:
undetectable		 4ltwA-4iruA:
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.
4MX0_A_BCZA513_0
(NEURAMINIDASE)		 4iru LEPB
(Legionella
pneumophila) 		5 / 12 LEU A 614
SER A 576
ARG A 573
GLU A 572
GLU A 534
 None
 1.26A 4mx0A-4iruA:
undetectable		 4mx0A-4iruA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XP6_A_B40A601_1
(TRANSPORTER)		 4iru LEPB
(Legionella
pneumophila) 		4 / 5 ASP A 361
VAL A 496
ASP A 493
GLY A 491
 None
 1.25A 4xp6A-4iruA:
undetectable		 4xp6A-4iruA:
20.29
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.
5IEO_A_VDYA206_2
(CDL2.3A)		 4iru LEPB
(Legionella
pneumophila) 		4 / 8 ILE A 349
MET A 355
LEU A 481
ILE A 484
 None
 0.93A 5ieoA-4iruA:
undetectable		 5ieoA-4iruA:
19.11