SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3gc6'

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.
1ISM_A_NCAA303_0
(BONE MARROW STROMAL
CELL ANTIGEN 1)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		5 / 9 TRP A 118
LEU A 137
ASP A 147
TRP A 181
SER A 185
 None
 0.45A 1ismA-3gc6A:
27.4		 1ismA-3gc6A:
33.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ISM_B_NCAB305_0
(BONE MARROW STROMAL
CELL ANTIGEN 1)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		4 / 7 TRP A 118
LEU A 137
ASP A 147
TRP A 181
 None
 0.42A 1ismB-3gc6A:
27.4		 1ismB-3gc6A:
33.33
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.
1QW6_A_H4BA901_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 ARG A 132
VAL A 199
TRP A 231
 None
 1.08A 1qw6A-3gc6A:
undetectable		 1qw6A-3gc6A:
19.01
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.
1QWC_A_H4BA901_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 ARG A 132
VAL A 199
TRP A 231
 None
 1.09A 1qwcA-3gc6A:
undetectable		 1qwcA-3gc6A:
19.01
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.
1R15_C_NCAC439_0
(ADP-RIBOSYL CYCLASE)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 TRP A 151
PHE A 180
TRP A 181
 None
 0.33A 1r15C-3gc6A:
25.8		 1r15C-3gc6A:
29.80
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.
1R15_F_NCAF469_0
(ADP-RIBOSYL CYCLASE)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 TRP A 151
PHE A 180
TRP A 181
 None
 0.31A 1r15F-3gc6A:
25.8		 1r15F-3gc6A:
29.80
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.
1R15_G_NCAG479_0
(ADP-RIBOSYL CYCLASE)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 TRP A 151
PHE A 180
TRP A 181
 None
 0.32A 1r15G-3gc6A:
25.9		 1r15G-3gc6A:
29.80
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.
1R15_H_NCAH489_0
(ADP-RIBOSYL CYCLASE)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 TRP A 151
PHE A 180
TRP A 181
 None
 0.33A 1r15H-3gc6A:
25.7		 1r15H-3gc6A:
29.80
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.
1SKX_A_RFPA1_1
(ORPHAN NUCLEAR
RECEPTOR PXR)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		5 / 12 VAL A 196
LEU A 252
ARG A 259
ILE A 255
PHE A 208
 None
 1.50A 1skxA-3gc6A:
undetectable		 1skxA-3gc6A:
21.56
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.
1VAG_A_H4BA901_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 ARG A 132
VAL A 199
TRP A 231
 None
 1.07A 1vagA-3gc6A:
undetectable		 1vagA-3gc6A:
19.01
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.
1ZVI_A_H4BA901_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 ARG A 132
VAL A 199
TRP A 231
 None
 1.04A 1zviA-3gc6A:
undetectable		 1zviA-3gc6A:
19.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DZG_A_NCAA302_0
(ADP-RIBOSYL CYCLASE
1)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		7 / 7 TRP A 118
LYS A 122
LEU A 137
GLU A 138
ASP A 147
TRP A 181
SER A 185
 None
 0.80A 3dzgA-3gc6A:
30.2		 3dzgA-3gc6A:
45.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DZG_B_NCAB302_0
(ADP-RIBOSYL CYCLASE
1)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		6 / 7 TRP A 118
LEU A 137
GLU A 138
ASP A 147
TRP A 181
SER A 185
 None
 0.55A 3dzgB-3gc6A:
30.5		 3dzgB-3gc6A:
45.91
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.
3FL9_D_TOPD200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		5 / 9 ALA A 219
LEU A 256
VAL A 198
ILE A 249
LEU A 232
 None
 1.38A 3fl9D-3gc6A:
undetectable		 3fl9D-3gc6A:
20.99
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.
3I9J_B_NCAB302_0
(ADP-RIBOSYL CYCLASE)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		4 / 6 LEU A 137
GLU A 138
TRP A 181
SER A 185
 None
 0.43A 3i9jB-3gc6A:
25.1		 3i9jB-3gc6A:
29.80
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.
3LW5_B_PQNB5002_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		5 / 10 ILE A 213
SER A 243
ALA A 230
LEU A 200
ALA A 207
 SO4  A 281 (-3.9A)
None
None
None
None
 1.27A 3lw5B-3gc6A:
undetectable		 3lw5B-3gc6A:
14.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ROP_A_NCAA302_0
(ADP-RIBOSYL CYCLASE
1)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		5 / 6 TRP A 118
LEU A 137
GLU A 138
TRP A 181
SER A 185
 None
 0.29A 3ropA-3gc6A:
30.6		 3ropA-3gc6A:
45.31
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.
4XK8_A_PQNA844_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		4 / 7 PHE A 214
SER A 212
ALA A 207
LEU A 200
 None
SO4  A 281 (-4.5A)
None
None
 1.11A 4xk8A-3gc6A:
undetectable		 4xk8A-3gc6A:
16.12
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.
4YIA_B_IMNB401_1
(THYROXINE-BINDING
GLOBULIN)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		5 / 10 SER A 248
SER A 243
LEU A 232
ASN A 201
LEU A 124
 None
None
None
NAG  A 501 (-1.9A)
NAG  A 501 ( 4.6A)
 1.08A 4yiaA-3gc6A:
undetectable		 4yiaA-3gc6A:
18.32
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.
5FVO_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3gc6 ECTO-NAD+
GLYCOHYDROLASE (CD38
MOLECULE)
(Bos
taurus) 		3 / 3 ARG A 132
VAL A 199
TRP A 231
 None
 1.10A 5fvoA-3gc6A:
undetectable		 5fvoA-3gc6A:
19.01