SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3b78'

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DMA_A_NCAA700_0
(EXOTOXIN A)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
7 / 7 HIS B 440
GLY B 441
TYR B 470
LEU B 477
ALA B 478
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.8A)
NAD  B 700 (-3.6A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.34A 1dmaA-3b78B:
33.1
1dmaA-3b78B:
99.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DMA_B_NCAB700_0
(EXOTOXIN A)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
6 / 6 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.51A 1dmaB-3b78B:
29.3
1dmaB-3b78B:
99.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJQ_D_SAMD200_0
(METHIONINE REPRESSOR)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 12 HIS B 440
ARG B 494
LEU B 444
GLU B 445
ALA B 447
NAD  B 700 (-3.9A)
None
None
None
None
1.05A 1mjqC-3b78B:
undetectable
1mjqD-3b78B:
undetectable
1mjqC-3b78B:
20.10
1mjqD-3b78B:
20.10
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.
2W3B_B_FOLB401_0
(DIHYDROFOLATE
REDUCTASE)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 12 ILE B 594
ALA B 425
ILE B 571
PRO B 572
TYR B 502
None
1.17A 2w3bB-3b78B:
undetectable
2w3bB-3b78B:
21.24
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.
3U9H_A_NCAA1163_0
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 8 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
0.56A 3u9hA-3b78B:
6.1
3u9hA-3b78B:
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.
3U9H_A_NCAA1163_0
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
4 / 8 HIS B 440
GLY B 441
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.81A 3u9hA-3b78B:
6.1
3u9hA-3b78B:
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.
3U9H_B_NCAB1164_0
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 8 HIS B 440
GLY B 441
ALA B 472
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
1.12A 3u9hB-3b78B:
6.0
3u9hB-3b78B:
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.
3U9H_B_NCAB1164_0
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 8 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
0.60A 3u9hB-3b78B:
6.0
3u9hB-3b78B:
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.
3VYW_B_SAMB401_0
(MNMC2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 12 TYR B 439
LEU B 498
ALA B 425
PHE B 436
LEU B 429
None
1.11A 3vywB-3b78B:
undetectable
3vywB-3b78B:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A97_I_ZPCI1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
4 / 6 GLU B 591
ILE B 594
TYR B 502
VAL B 455
None
None
None
NAD  B 700 ( 3.6A)
1.14A 4a97I-3b78B:
undetectable
4a97I-3b78B:
19.23
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.
4AE1_A_NCAA1536_0
(DIPHTHERIA TOXIN)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
6 / 6 HIS B 440
GLY B 441
TYR B 470
ALA B 478
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.6A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.49A 4ae1A-3b78B:
9.4
4ae1A-3b78B:
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.
4AE1_B_NCAB1536_0
(DIPHTHERIA TOXIN)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 5 HIS B 440
GLY B 441
TYR B 470
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.38A 4ae1B-3b78B:
7.0
4ae1B-3b78B:
15.49
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.
4BJC_A_RPBA2162_1
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 8 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
0.43A 4bjcA-3b78B:
6.0
4bjcA-3b78B:
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.
4BJC_A_RPBA2162_1
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
4 / 8 HIS B 440
GLY B 441
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.72A 4bjcA-3b78B:
6.0
4bjcA-3b78B:
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.
4HYF_A_NCAA1201_0
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
6 / 7 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.66A 4hyfA-3b78B:
6.3
4hyfA-3b78B:
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.
4HYF_B_NCAB1201_0
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
6 / 8 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.68A 4hyfB-3b78B:
6.3
4hyfB-3b78B:
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.
4HYF_C_NCAC1201_0
(TANKYRASE-2)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
6 / 8 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.63A 4hyfC-3b78B:
6.5
4hyfC-3b78B:
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.
4IAQ_A_2GMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 12 ASP B 406
ALA B 399
PHE B 452
LEU B 444
PHE B 409
None
1.34A 4iaqA-3b78B:
undetectable
4iaqA-3b78B:
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.
4IAR_A_ERMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 12 ASP B 406
ALA B 399
PHE B 452
LEU B 444
PHE B 409
None
1.32A 4iarA-3b78B:
undetectable
4iarA-3b78B:
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.
4RV6_A_RPBA1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
6 / 11 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.37A 4rv6A-3b78B:
6.0
4rv6A-3b78B:
20.90
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.
4RV6_B_RPBB1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
6 / 11 HIS B 440
GLY B 441
TYR B 470
ALA B 472
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 ( 4.2A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.37A 4rv6B-3b78B:
6.3
4rv6B-3b78B:
20.90
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.
4XE3_A_CL6A502_1
(CYTOCHROME P-450)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
4 / 5 LEU B 508
ALA B 541
THR B 554
ILE B 471
None
0.94A 4xe3A-3b78B:
undetectable
4xe3A-3b78B:
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.
5TE8_C_08JC602_1
(CYTOCHROME P450 3A4)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 7 SER B 507
LEU B 560
ALA B 541
THR B 554
ILE B 471
None
1.40A 5te8C-3b78B:
undetectable
5te8C-3b78B:
17.50
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.
6G9B_B_IXXB705_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN
ENVELOPE
GLYCOPROTEIN)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
4 / 5 ARG B 500
ALA B 570
GLN B 592
ILE B 587
None
1.19A 6g9bA-3b78B:
undetectable
6g9bB-3b78B:
undetectable
6g9bA-3b78B:
19.65
6g9bB-3b78B:
21.69
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.
6QYA_B_FOZB401_0
(THYMIDYLATE SYNTHASE)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 12 LEU B 518
ILE B 542
HIS B 533
LEU B 556
GLY B 557
None
1.15A 6qyaB-3b78B:
undetectable
6qyaB-3b78B:
21.90
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.
6QYA_D_FOZD401_0
(THYMIDYLATE SYNTHASE)
3b78 EXOTOXIN A
(Pseudomonas
aeruginosa)
5 / 12 LEU B 518
ILE B 542
HIS B 533
LEU B 556
GLY B 557
None
1.16A 6qyaD-3b78B:
undetectable
6qyaD-3b78B:
21.90