SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qq1'

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.
3A51_B_VDYB6178_1
(VITAMIN D
HYDROXYLASE)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 12 LEU A 134
ILE A 152
THR A 166
VAL A  37
LEU A  34
None
1.32A 3a51B-2qq1A:
undetectable
3a51B-2qq1A:
19.95
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.
3BOG_D_DHID8_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 4 SER A  26
GLY A  27
GLY A 136
GLY A  76
None
0.91A 3bogB-2qq1A:
undetectable
3bogD-2qq1A:
undetectable
3bogB-2qq1A:
undetectable
3bogD-2qq1A:
undetectable
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.
3ELZ_A_CHDA150_0
(ILEAL BILE
ACID-BINDING PROTEIN)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 12 PHE A 101
MET A 105
VAL A 132
LEU A 130
TYR A  33
None
1.26A 3elzA-2qq1A:
undetectable
3elzA-2qq1A:
21.71
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.
3N8Y_B_SALB900_1
(PROSTAGLANDIN G/H
SYNTHASE 1)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 5 VAL A  10
LEU A  73
ILE A 141
ALA A  29
None
0.92A 3n8yB-2qq1A:
undetectable
3n8yB-2qq1A:
13.41
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.
3NU4_B_478B401_1
(PROTEASE)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 9 ALA A   6
ILE A  38
GLY A   9
ILE A  72
ILE A 164
None
0.70A 3nu4A-2qq1A:
undetectable
3nu4A-2qq1A:
22.41
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.
3OGP_B_017B200_2
(FIV PROTEASE)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 9 GLY A  27
ILE A  13
GLY A   9
ILE A   8
LEU A 134
None
1.02A 3ogpB-2qq1A:
undetectable
3ogpB-2qq1A:
25.83
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.
3S43_A_478A401_1
(PROTEASE)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 9 ALA A   6
ILE A  38
GLY A   9
ILE A  72
ILE A 164
None
0.71A 3s43A-2qq1A:
undetectable
3s43A-2qq1A:
22.41
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.
3S45_B_478B201_1
(PROTEASE)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 9 ALA A   6
ILE A  38
GLY A   9
ILE A  72
ILE A 164
None
0.84A 3s45A-2qq1A:
undetectable
3s45A-2qq1A:
20.45
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.
3W1W_A_CHDA1503_0
(FERROCHELATASE,
MITOCHONDRIAL)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 8 MET A 149
ILE A  38
VAL A  10
GLY A   9
None
0.76A 3w1wA-2qq1A:
6.1
3w1wA-2qq1A:
18.28
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.
3W1W_B_CHDB504_0
(FERROCHELATASE,
MITOCHONDRIAL)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 12 LEU A  73
LEU A 134
ILE A 164
VAL A 108
VAL A 171
None
1.35A 3w1wB-2qq1A:
6.2
3w1wB-2qq1A:
18.28
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.
4Q1X_A_017A101_2
(ASPARTYL PROTEASE)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 12 ALA A   6
ILE A  38
GLY A   9
ILE A  72
ILE A 164
None
0.86A 4q1xB-2qq1A:
undetectable
4q1xB-2qq1A:
20.69
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.
5E5J_A_017A201_3
(PROTEASE)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
3 / 3 ASP A 146
VAL A 108
LEU A 104
None
0.62A 5e5jB-2qq1A:
undetectable
5e5jB-2qq1A:
22.41
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.
5ECK_A_ILEA601_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 6 ALA A  89
THR A  90
VAL A  93
VAL A  11
None
0.85A 5eckA-2qq1A:
undetectable
5eckA-2qq1A:
15.97
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.
5ECK_D_ILED601_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 6 ALA A  89
THR A  90
VAL A  93
VAL A  11
None
0.90A 5eckD-2qq1A:
undetectable
5eckD-2qq1A:
15.97
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.
5ECL_A_ILEA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 6 ALA A  89
THR A  90
VAL A  93
VAL A  11
None
0.61A 5eclA-2qq1A:
undetectable
5eclA-2qq1A:
15.97
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.
5ECL_D_ILED602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 6 ALA A  89
THR A  90
VAL A  93
VAL A  11
None
0.68A 5eclD-2qq1A:
undetectable
5eclD-2qq1A:
15.97
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.
5ECN_D_LEUD602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 8 ILE A  72
ALA A  89
VAL A  93
VAL A  11
None
0.83A 5ecnD-2qq1A:
undetectable
5ecnD-2qq1A:
15.97
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.
5T8H_B_478B401_2
(PROTEASE)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
5 / 12 ALA A   6
ILE A  38
GLY A   9
ILE A  72
ILE A 164
None
0.89A 5t8hB-2qq1A:
undetectable
5t8hB-2qq1A:
22.41
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.
5XDX_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT VIIA-HEART)
2qq1 MOLYBDENUM COFACTOR
BIOSYNTHESIS MOG

(Aquifex
aeolicus)
4 / 7 ILE A   8
LEU A  71
THR A  75
LEU A 134
None
0.96A 5xdxA-2qq1A:
undetectable
5xdxJ-2qq1A:
undetectable
5xdxA-2qq1A:
14.76
5xdxJ-2qq1A:
23.19