SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4qgl'

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.
1MAG_A_DVAA6_0
(GRAMICIDIN A)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		3 / 3 ALA A  65
VAL A  67
TRP A  33
 None
 0.96A 1magA-4qglA:
undetectable		 1magA-4qglA:
5.85
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.
1MAG_B_DVAB6_0
(GRAMICIDIN A)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		3 / 3 ALA A  65
VAL A  67
TRP A  33
 None
 0.96A 1magB-4qglA:
undetectable		 1magB-4qglA:
5.85
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.
1NT6_A_DVAA6_0
(GRAMICIDIN C)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		3 / 3 ALA A  65
VAL A  67
TRP A  33
 None
 0.83A 1nt6A-4qglA:
undetectable		 1nt6A-4qglA:
5.85
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.
1NT6_B_DVAB6_0
(GRAMICIDIN C)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		3 / 3 ALA A  65
VAL A  67
TRP A  33
 None
 0.83A 1nt6B-4qglA:
undetectable		 1nt6B-4qglA:
5.85
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.
1OS2_A_HAEA874_1
(MACROPHAGE
METALLOELASTASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 5 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.13A 1os2A-4qglA:
undetectable		 1os2A-4qglA:
21.43
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.
1OS2_D_HAED574_1
(MACROPHAGE
METALLOELASTASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.14A 1os2D-4qglA:
undetectable		 1os2D-4qglA:
21.43
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.
1UTT_A_HAEA1265_1
(MACROPHAGE
METALLOELASTASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.19A 1uttA-4qglA:
undetectable		 1uttA-4qglA:
22.47
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.
1UTZ_A_HAEA1267_1
(MACROPHAGE
METALLOELASTASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.13A 1utzA-4qglA:
undetectable		 1utzA-4qglA:
22.47
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.
1UTZ_B_HAEB1266_1
(MACROPHAGE
METALLOELASTASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.18A 1utzB-4qglA:
undetectable		 1utzB-4qglA:
22.47
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.
2HU6_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.14A 2hu6A-4qglA:
undetectable		 2hu6A-4qglA:
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.
2OW9_B_HAEB502_1
(COLLAGENASE 3)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.12A 2ow9B-4qglA:
undetectable		 2ow9B-4qglA:
26.29
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.
2OZR_C_HAEC3001_1
(COLLAGENASE 3)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.11A 2ozrC-4qglA:
undetectable		 2ozrC-4qglA:
26.29
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.
2OZR_D_HAED3002_1
(COLLAGENASE 3)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.08A 2ozrD-4qglA:
undetectable		 2ozrD-4qglA:
26.29
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.
2OZR_E_HAEE3003_1
(COLLAGENASE 3)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.19A 2ozrE-4qglA:
undetectable		 2ozrE-4qglA:
26.29
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.
3CO4_A_GCSA401_1
(CHITINASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		3 / 3 GLU A 119
HIS A  99
HIS A 100
 None
CD  A 201 (-3.5A)
None
 0.79A 3co4A-4qglA:
undetectable		 3co4A-4qglA:
20.66
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.
3KP6_B_SALB3004_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 5 ILE A 136
PHE A 116
ASP A 127
GLU A 129
 None
 1.06A 3kp6A-4qglA:
undetectable
3kp6B-4qglA:
undetectable		 3kp6A-4qglA:
27.17
3kp6B-4qglA:
27.17
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.
3LIL_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.17A 3lilA-4qglA:
undetectable		 3lilA-4qglA:
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.
3SJ1_X_DXCX75_0
(CYTOCHROME C7)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 6 ILE A 136
LEU A  23
PHE A 126
GLY A 120
 None
 0.88A 3sj1X-4qglA:
undetectable		 3sj1X-4qglA:
16.18
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.
5N5J_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		4 / 4 HIS A 144
GLU A 105
HIS A 101
HIS A  99
 CD  A 201 (-3.7A)
CD  A 201 ( 2.7A)
CD  A 201 (-3.5A)
CD  A 201 (-3.5A)
 1.16A 5n5jA-4qglA:
undetectable		 5n5jA-4qglA:
22.60
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.
5ZRD_A_CUA607_0
(TYROSINASE)		 4qgl ACIREDUCTONE
DIOXYGENASE
(Bacillus
anthracis) 		3 / 3 HIS A  99
HIS A 144
HIS A 101
 CD  A 201 (-3.5A)
CD  A 201 (-3.7A)
CD  A 201 (-3.5A)
 0.42A 5zrdA-4qglA:
undetectable		 5zrdA-4qglA:
16.05