SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'NGW'


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.
3LMY_A_CP6A562_1
(BETA-HEXOSAMINIDASE
SUBUNIT BETA)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		6 / 12 ARG A 641
ASP A 671
HIS A 742
ASP A 804
TRP A 872
TYR A 902
 NGW  A2042 (-2.9A)
None
NGW  A2042 (-4.0A)
NGW  A2042 (-3.6A)
NGW  A2042 (-3.7A)
MG  A2045 ( 4.4A)
 0.91A 3lmyA-4azcA:
27.2		 3lmyA-4azcA:
21.92
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.
3LMY_A_CP6A562_1
(BETA-HEXOSAMINIDASE
SUBUNIT BETA)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		6 / 12 ARG A 641
HIS A 742
ASP A 804
TRP A 872
TYR A 902
TRP A 951
 NGW  A2042 (-2.9A)
NGW  A2042 (-4.0A)
NGW  A2042 (-3.6A)
NGW  A2042 (-3.7A)
MG  A2045 ( 4.4A)
NGW  A2042 (-3.8A)
 0.54A 3lmyA-4azcA:
27.2		 3lmyA-4azcA:
21.92
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.
3LMY_B_CP6B563_1
(BETA-HEXOSAMINIDASE
SUBUNIT BETA)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		7 / 12 ARG A 641
ASP A 671
HIS A 742
ASP A 804
GLU A 805
TRP A 872
TYR A 902
 NGW  A2042 (-2.9A)
None
NGW  A2042 (-4.0A)
NGW  A2042 (-3.6A)
NGW  A2042 (-3.2A)
NGW  A2042 (-3.7A)
MG  A2045 ( 4.4A)
 0.88A 3lmyB-4azcA:
27.3		 3lmyB-4azcA:
21.92
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.
3LMY_B_CP6B563_1
(BETA-HEXOSAMINIDASE
SUBUNIT BETA)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		7 / 12 ARG A 641
HIS A 742
ASP A 804
GLU A 805
TRP A 872
TYR A 902
TRP A 951
 NGW  A2042 (-2.9A)
NGW  A2042 (-4.0A)
NGW  A2042 (-3.6A)
NGW  A2042 (-3.2A)
NGW  A2042 (-3.7A)
MG  A2045 ( 4.4A)
NGW  A2042 (-3.8A)
 0.56A 3lmyB-4azcA:
27.3		 3lmyB-4azcA:
21.92
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.
4AF0_A_MOAA1526_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 8 ASP A 804
SER A 739
MET A 770
GLY A 669
 NGW  A2042 (-3.6A)
None
None
None
 1.01A 4af0A-4azcA:
4.7		 4af0A-4azcA:
22.30
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.
4FEU_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 7 ASP A 953
ASP A 638
ASP A 744
ASN A 670
 NGW  A2042 (-2.9A)
None
None
NGW  A2042 ( 4.5A)
 1.03A 4feuB-4azcA:
undetectable		 4feuB-4azcA:
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.
4FEW_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 8 ASP A 953
ASP A 638
ASP A 744
ASN A 670
 NGW  A2042 (-2.9A)
None
None
NGW  A2042 ( 4.5A)
 1.21A 4fewD-4azcA:
undetectable		 4fewD-4azcA:
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.
4FEW_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 8 ASP A 953
ASP A 638
ASP A 744
ASN A 670
 NGW  A2042 (-2.9A)
None
None
NGW  A2042 ( 4.5A)
 1.18A 4fewF-4azcA:
undetectable		 4fewF-4azcA:
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.
4GKI_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 8 ASP A 953
ASP A 638
ASP A 744
ASN A 670
 NGW  A2042 (-2.9A)
None
None
NGW  A2042 ( 4.5A)
 1.20A 4gkiA-4azcA:
undetectable		 4gkiA-4azcA:
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.
4GKI_C_KANC301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 8 ASP A 953
ASP A 638
ASP A 744
ASN A 670
 NGW  A2042 (-2.9A)
None
None
NGW  A2042 ( 4.5A)
 1.20A 4gkiC-4azcA:
undetectable		 4gkiC-4azcA:
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.
4OBW_D_SAMD601_1
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		3 / 3 ASN A 808
ASP A 804
ASP A 638
 None
NGW  A2042 (-3.6A)
None
 0.71A 4obwD-4azcA:
undetectable		 4obwD-4azcA:
23.41
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.
6GH9_A_MIXA1003_0
(UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 15)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 5 ASN A 808
GLY A 640
HIS A 742
ASP A 804
 None
None
NGW  A2042 (-4.0A)
NGW  A2042 (-3.6A)
 0.89A 6gh9A-4azcA:
undetectable		 6gh9A-4azcA:
11.09
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.
6GH9_A_MIXA1003_0
(UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 15)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 5 ASN A 808
GLY A 672
HIS A 742
ASP A 804
 None
None
NGW  A2042 (-4.0A)
NGW  A2042 (-3.6A)
 0.85A 6gh9A-4azcA:
undetectable		 6gh9A-4azcA:
11.09
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.
6NMF_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4azc BETA-N-ACETYLHEXOSAM
INIDASE
(Streptococcus
pneumoniae) 		4 / 7 TRP A 816
ASP A 763
THR A 811
HIS A 742
 None
None
None
NGW  A2042 (-4.0A)
 1.46A 6nmfN-4azcA:
undetectable
6nmfP-4azcA:
undetectable		 6nmfN-4azcA:
21.22
6nmfP-4azcA:
20.00