SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'UHB'


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.
1DMA_A_NCAA700_0
(EXOTOXIN A)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
4 / 7 HIS A 415
GLY A 416
TYR A 449
TYR A 460
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 (-3.4A)
0.31A 1dmaA-5dsyA:
5.8
1dmaA-5dsyA:
21.01
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.
1DMA_A_NCAA700_0
(EXOTOXIN A)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
4 / 7 HIS A 415
GLY A 416
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.52A 1dmaA-5dsyA:
5.8
1dmaA-5dsyA:
21.01
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.
1DMA_B_NCAB700_0
(EXOTOXIN A)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
6 / 6 HIS A 415
GLY A 416
TYR A 449
ALA A 451
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.52A 1dmaB-5dsyA:
5.1
1dmaB-5dsyA:
21.01
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.
1ERR_A_RALA600_2
(ESTROGEN RECEPTOR)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
4 / 6 LEU A 412
HIS A 415
LEU A 391
LEU A 359
None
UHB  A1001 (-3.7A)
None
None
0.88A 1errA-5dsyA:
undetectable
1errA-5dsyA:
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.
2XAT_A_CLMA301_0
(XENOBIOTIC
ACETYLTRANSFERASE)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
3 / 3 GLY A 416
TYR A 460
SER A 457
UHB  A1001 (-3.9A)
UHB  A1001 (-3.4A)
UHB  A1001 (-2.5A)
0.75A 2xatA-5dsyA:
undetectable
2xatA-5dsyA:
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.
3U9H_A_NCAA1163_0
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
6 / 8 HIS A 415
GLY A 416
TYR A 449
ALA A 451
SER A 457
TYR A 460
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
0.42A 3u9hA-5dsyA:
18.6
3u9hA-5dsyA:
29.11
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.
3U9H_A_NCAA1163_0
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
6 / 8 HIS A 415
GLY A 416
TYR A 449
LYS A 456
SER A 457
TYR A 460
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.6A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
0.96A 3u9hA-5dsyA:
18.6
3u9hA-5dsyA:
29.11
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.
3U9H_A_NCAA1163_0
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
6 / 8 HIS A 415
GLY A 416
TYR A 449
SER A 457
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.81A 3u9hA-5dsyA:
18.6
3u9hA-5dsyA:
29.11
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.
3U9H_B_NCAB1164_0
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
7 / 8 HIS A 415
GLY A 416
TYR A 449
ALA A 451
SER A 457
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.81A 3u9hB-5dsyA:
18.6
3u9hB-5dsyA:
29.11
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.
3U9H_B_NCAB1164_0
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
6 / 8 HIS A 415
GLY A 416
TYR A 449
LYS A 456
SER A 457
TYR A 460
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.6A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
1.00A 3u9hB-5dsyA:
18.6
3u9hB-5dsyA:
29.11
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.
4AE1_A_NCAA1536_0
(DIPHTHERIA TOXIN)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
5 / 6 HIS A 415
GLY A 416
TYR A 449
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.69A 4ae1A-5dsyA:
5.4
4ae1A-5dsyA:
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)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
5 / 5 HIS A 415
GLY A 416
TYR A 449
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.75A 4ae1B-5dsyA:
5.7
4ae1B-5dsyA:
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.
4BJC_A_RPBA2162_1
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
7 / 8 HIS A 415
GLY A 416
TYR A 449
ALA A 451
LYS A 456
SER A 457
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 ( 4.6A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.5A)
1.29A 4bjcA-5dsyA:
18.4
4bjcA-5dsyA:
29.11
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.
4BJC_A_RPBA2162_1
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
7 / 8 HIS A 415
GLY A 416
TYR A 449
ALA A 451
SER A 457
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.78A 4bjcA-5dsyA:
18.4
4bjcA-5dsyA:
29.11
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.
4HYF_A_NCAA1201_0
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
7 / 7 HIS A 415
GLY A 416
TYR A 449
ALA A 451
SER A 457
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.61A 4hyfA-5dsyA:
19.5
4hyfA-5dsyA:
29.11
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.
4HYF_B_NCAB1201_0
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
8 / 8 HIS A 415
GLY A 416
TYR A 449
ALA A 451
LYS A 456
SER A 457
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 ( 4.6A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.93A 4hyfB-5dsyA:
19.7
4hyfB-5dsyA:
29.11
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.
4HYF_C_NCAC1201_0
(TANKYRASE-2)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
8 / 8 HIS A 415
GLY A 416
TYR A 449
ALA A 451
LYS A 456
SER A 457
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 ( 4.6A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.57A 4hyfC-5dsyA:
19.6
4hyfC-5dsyA:
29.11
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.
4J26_A_ESTA600_1
(ESTROGEN RECEPTOR
BETA)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
5 / 12 LEU A 471
MET A 556
LEU A 356
GLY A 429
LEU A 430
None
None
None
None
UHB  A1001 ( 4.7A)
1.29A 4j26A-5dsyA:
undetectable
4j26A-5dsyA:
23.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4RV6_A_RPBA1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
9 / 11 HIS A 415
GLY A 416
TYR A 442
TYR A 449
ALA A 451
LYS A 456
SER A 457
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 ( 4.7A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 ( 4.6A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.57A 4rv6A-5dsyA:
35.2
4rv6A-5dsyA:
40.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4RV6_B_RPBB1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
9 / 11 HIS A 415
GLY A 416
TYR A 442
TYR A 449
ALA A 451
LYS A 456
SER A 457
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 ( 4.7A)
UHB  A1001 (-3.8A)
UHB  A1001 ( 4.1A)
UHB  A1001 ( 4.6A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.57A 4rv6B-5dsyA:
36.1
4rv6B-5dsyA:
40.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HA9_B_TP0B406_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
7 / 9 HIS A 415
SER A 417
ASN A 421
ILE A 425
TYR A 449
SER A 457
TYR A 460
UHB  A1001 (-3.7A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.7A)
UHB  A1001 (-4.6A)
UHB  A1001 (-3.8A)
UHB  A1001 (-2.5A)
UHB  A1001 (-3.4A)
0.53A 5ha9B-5dsyA:
32.8
5ha9B-5dsyA:
40.17
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.
5Y2T_A_8LXA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2

(Homo
sapiens)
5 / 12 PHE A 444
GLY A 445
TYR A 460
ILE A 432
LEU A 541
None
None
UHB  A1001 (-3.4A)
None
None
1.01A 5y2tA-5dsyA:
undetectable
5y2tA-5dsyA:
undetectable