SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3qw4'

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.
1FM6_D_BRLD503_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		4 / 4 ILE B 248
LEU B 184
VAL B 198
ILE B 201
 None
 0.89A 1fm6D-3qw4B:
undetectable		 1fm6D-3qw4B:
21.44
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.
1HWI_A_115A2_2
(HMG-COA REDUCTASE)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		4 / 8 ASN B  51
LEU B  81
ALA B  99
LEU B 103
 U5P  B7485 (-3.3A)
None
None
None
 0.89A 1hwiB-3qw4B:
undetectable		 1hwiB-3qw4B:
23.36
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.
1HWI_C_115C4_2
(HMG-COA REDUCTASE)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		4 / 8 ASN B  51
LEU B  81
ALA B  99
LEU B 103
 U5P  B7485 (-3.3A)
None
None
None
 0.88A 1hwiD-3qw4B:
undetectable		 1hwiD-3qw4B:
23.36
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.
1HWI_D_115D3_1
(HMG-COA REDUCTASE)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		4 / 8 ASN B  51
LEU B  81
ALA B  99
LEU B 103
 U5P  B7485 (-3.3A)
None
None
None
 0.88A 1hwiC-3qw4B:
undetectable		 1hwiC-3qw4B:
23.36
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_A_IMNA2_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		4 / 6 ILE B 248
ILE B  77
TYR B  48
LEU B 208
 None
 1.03A 3adsA-3qw4B:
undetectable		 3adsA-3qw4B:
21.98
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.
3IXL_A_PACA5000_0
(ARYLMALONATE
DECARBOXYLASE)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		5 / 10 THR B 179
SER B 137
VAL B 227
GLY B 205
GLY B 202
 None
U5P  B7485 (-2.8A)
U5P  B7485 ( 4.5A)
None
None
 1.22A 3ixlA-3qw4B:
undetectable		 3ixlA-3qw4B:
21.74
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.
3KKZ_A_SAMA301_0
(UNCHARACTERIZED
PROTEIN Q5LES9)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		5 / 12 GLY B  62
GLY B  59
LEU B  66
PHE B  54
ALA B  27
 None
 1.09A 3kkzA-3qw4B:
undetectable		 3kkzA-3qw4B:
22.04
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.
3MG0_Y_BO2Y1403_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		6 / 12 ALA B  28
THR B  26
ALA B  24
ALA B  29
ALA B  60
ALA B  65
 None
 1.36A 3mg0Y-3qw4B:
undetectable
3mg0Z-3qw4B:
undetectable		 3mg0Y-3qw4B:
18.41
3mg0Z-3qw4B:
19.15
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.
3UJ6_A_SAMA300_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		5 / 12 ILE B 370
ILE B 333
ILE B 299
ASP B 372
LEU B 265
 None
 1.00A 3uj6A-3qw4B:
3.6		 3uj6A-3qw4B:
19.39
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.
4LTW_A_486A302_1
(ANCESTRAL STEROID
RECEPTOR 2)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		5 / 12 LEU B 424
VAL B 401
LEU B 293
ILE B 288
ILE B 286
 None
 0.94A 4ltwA-3qw4B:
undetectable		 4ltwA-3qw4B:
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.
4Y03_A_SALA801_1
(PROTEIN POLYBROMO-1)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		5 / 7 ILE B 370
LEU B 400
MET B 300
ALA B 304
ILE B 333
 None
 1.14A 4y03A-3qw4B:
undetectable		 4y03A-3qw4B:
12.78
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.
5DZK_T_BEZT801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		4 / 5 SER B 331
ALA B 330
MET B 300
LEU B 327
 None
 1.39A 5dzkf-3qw4B:
undetectable
5dzkt-3qw4B:
undetectable		 5dzkf-3qw4B:
19.91
5dzkt-3qw4B:
25.00
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.
5HIE_A_P06A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		4 / 7 ILE B  77
GLY B  76
PHE B 100
CYH B  17
 None
 0.88A 5hieA-3qw4B:
undetectable		 5hieA-3qw4B:
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.
5N5D_A_SAMA306_0
(METHYLTRANSFERASE)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		5 / 12 VAL B 187
GLY B 173
TYR B 155
ALA B 129
PHE B 196
 None
 1.12A 5n5dA-3qw4B:
undetectable		 5n5dA-3qw4B:
19.44
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.
6DK1_C_GM4C301_0
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 3qw4 UMP SYNTHASE
(Leishmania
donovani) 		5 / 11 VAL B  79
ALA B 105
ASP B  21
THR B 109
ALA B 107
 None
None
U5P  B7485 (-3.4A)
None
None
 1.42A 6dk1C-3qw4B:
undetectable		 6dk1C-3qw4B:
17.88