SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4pq9'

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.
1AV2_A_DVAA8_0
(GRAMICIDIN A)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		4 / 4 VAL A 257
TRP A 254
VAL A 255
TRP A 258
 None
 1.49A 1av2A-4pq9A:
undetectable
1av2B-4pq9A:
undetectable		 1av2A-4pq9A:
4.76
1av2B-4pq9A:
4.76
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.
2ACL_C_REAC503_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		5 / 10 ILE A  90
ALA A 101
ALA A  92
ARG A  55
ILE A 120
 None
 1.14A 2aclC-4pq9A:
undetectable		 2aclC-4pq9A:
20.14
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.
3E00_A_9CRA7223_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		6 / 12 ILE A  90
ALA A 101
ALA A  92
ARG A  55
VAL A 252
ILE A 120
 None
 1.38A 3e00A-4pq9A:
undetectable		 3e00A-4pq9A:
19.66
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.
3EM0_A_CHDA151_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		5 / 10 CYH A 185
ILE A 145
VAL A 208
GLY A 191
TYR A 223
 None
 1.20A 3em0A-4pq9A:
undetectable		 3em0A-4pq9A:
19.38
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.
3FAL_A_REAA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		6 / 10 ILE A  90
ALA A 101
ALA A  92
ARG A  55
VAL A 252
ILE A 120
 None
 1.26A 3falA-4pq9A:
undetectable		 3falA-4pq9A:
20.48
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.
3KU1_A_SAMA226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		5 / 12 VAL A 225
GLY A 141
ALA A 210
GLY A 191
MET A 192
 None
 0.96A 3ku1A-4pq9A:
undetectable		 3ku1A-4pq9A:
21.82
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.
3L8L_A_DVAA8_0
(GRAMICIDIN D)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		4 / 4 VAL A 257
TRP A 254
VAL A 255
TRP A 258
 None
 1.44A 3l8lA-4pq9A:
undetectable
3l8lB-4pq9A:
undetectable		 3l8lA-4pq9A:
4.76
3l8lB-4pq9A:
4.76
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.
3NXU_A_RITA600_1
(CYTOCHROME P450 3A4)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		5 / 12 LEU A 176
PHE A 122
ALA A 157
GLU A  56
GLY A 238
 None
None
None
BTB  A 303 ( 4.6A)
None
 1.08A 3nxuA-4pq9A:
undetectable		 3nxuA-4pq9A:
19.46
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.
4M93_B_ACTB303_0
(S25-26 FAB (IGG1K)
HEAVY CHAIN
S25-26 FAB (IGG1K)
LIGHT CHAIN)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		4 / 5 GLY A  41
SER A  42
ALA A  43
PHE A  81
 None
 1.05A 4m93B-4pq9A:
undetectable
4m93C-4pq9A:
undetectable		 4m93B-4pq9A:
20.38
4m93C-4pq9A:
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.
4RKU_A_PQNA5001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		4 / 8 MET A 250
PHE A 122
LEU A 176
PHE A 218
 None
 0.98A 4rkuA-4pq9A:
undetectable
4rkuJ-4pq9A:
undetectable		 4rkuA-4pq9A:
15.43
4rkuJ-4pq9A:
13.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4XDQ_A_BEZA306_0
(GLYCOSIDE HYDROLASE
FAMILY PROTEIN)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		3 / 3 ARG A 119
ASP A 253
TRP A 254
 None
MG  A 301 (-3.1A)
None
 0.17A 4xdqA-4pq9A:
37.1		 4xdqA-4pq9A:
56.88
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.
6BXL_B_SAMB401_0
(2-(3-AMINO-3-CARBOXY
PROPYL)HISTIDINE
SYNTHASE)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		5 / 12 GLY A 166
SER A 212
VAL A 208
VAL A 160
ASP A 144
 None
None
None
None
BTB  A 303 (-3.8A)
 1.18A 6bxlB-4pq9A:
undetectable		 6bxlB-4pq9A:
21.30
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.
6EW0_B_TA1B501_2
(TUBULIN BETA CHAIN)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		4 / 5 LEU A 135
THR A 159
ARG A 140
PRO A 217
 None
EDO  A 304 ( 3.5A)
None
None
 1.16A 6ew0B-4pq9A:
undetectable		 6ew0B-4pq9A:
15.56
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.
6EW0_D_TA1D501_2
(TUBULIN BETA CHAIN)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		4 / 5 LEU A 135
THR A 159
ARG A 140
PRO A 217
 None
EDO  A 304 ( 3.5A)
None
None
 1.16A 6ew0D-4pq9A:
undetectable		 6ew0D-4pq9A:
15.56
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.
6EW0_H_TA1H501_2
(TUBULIN BETA CHAIN)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		4 / 5 LEU A 135
THR A 159
ARG A 140
PRO A 217
 None
EDO  A 304 ( 3.5A)
None
None
 1.16A 6ew0H-4pq9A:
undetectable		 6ew0H-4pq9A:
15.56
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.
6EW0_I_TA1I501_2
(TUBULIN BETA CHAIN)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		4 / 5 LEU A 135
THR A 159
ARG A 140
PRO A 217
 None
EDO  A 304 ( 3.5A)
None
None
 1.16A 6ew0I-4pq9A:
undetectable		 6ew0I-4pq9A:
15.56
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.
6H0G_E_Y70E502_0
(PROTEIN CEREBLON
ZINC FINGER PROTEIN
692)		 4pq9 BETA-1,3-GLUCANASE
(Mycobacterium
marinum) 		5 / 12 PRO A 131
GLU A 147
SER A 156
TRP A 148
GLY A 237
 None
BTB  A 303 (-2.7A)
None
None
None
 1.45A 6h0gE-4pq9A:
0.0
6h0gF-4pq9A:
undetectable		 6h0gE-4pq9A:
18.11
6h0gF-4pq9A:
9.04