SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2iex'

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.
1MXD_A_ACRA734_1
(ALPHA AMYLASE)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		4 / 6 ASN A 136
HIS A  33
TYR A 116
GLY A  67
 None
 1.06A 1mxdA-2iexA:
2.6		 1mxdA-2iexA:
19.36
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.
1MXG_A_ACRA444_1
(ALPHA AMYLASE)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		4 / 7 ASN A 136
HIS A  33
TYR A 116
GLY A  67
 None
 1.08A 1mxgA-2iexA:
2.6		 1mxgA-2iexA:
19.36
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.
1RG7_A_MTXA161_2
(DIHYDROFOLATE
REDUCTASE)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		3 / 3 ILE A  61
ILE A  22
THR A  26
 None
 0.41A 1rg7A-2iexA:
undetectable		 1rg7A-2iexA:
19.47
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.
2XKW_B_P1BB1475_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		4 / 6 LEU A 197
ILE A 132
ILE A 216
LEU A 209
 None
 0.84A 2xkwB-2iexA:
undetectable		 2xkwB-2iexA:
22.44
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.
3KU1_A_SAMA226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		5 / 12 LEU A 194
GLY A  66
ALA A 114
GLY A 115
ILE A  27
 None
 0.94A 3ku1A-2iexA:
undetectable		 3ku1A-2iexA:
22.18
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.
3KU1_C_SAMC226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		5 / 12 LEU A 194
GLY A  66
ALA A 114
GLY A 115
ILE A  27
 None
 0.91A 3ku1C-2iexA:
undetectable		 3ku1C-2iexA:
22.18
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.
4DU2_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT B7)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		4 / 7 ALA A 133
PHE A 139
ALA A 117
ALA A 111
 None
 0.83A 4du2A-2iexA:
undetectable		 4du2A-2iexA:
20.97
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.
4DU2_B_LDPB501_1
(CYTOCHROME P450 BM3
VARIANT B7)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		4 / 7 ALA A 133
PHE A 139
ALA A 117
ALA A 111
 None
 0.76A 4du2B-2iexA:
undetectable		 4du2B-2iexA:
20.97
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.
4QVY_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		5 / 10 ALA A 179
THR A 178
ALA A 182
VAL A 191
GLY A 115
 None
 1.00A 4qvyK-2iexA:
undetectable
4qvyL-2iexA:
undetectable		 4qvyK-2iexA:
21.13
4qvyL-2iexA:
26.12
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.
4QVY_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		5 / 10 ALA A 179
THR A 178
ALA A 182
VAL A 191
GLY A 115
 None
 1.00A 4qvyY-2iexA:
undetectable
4qvyZ-2iexA:
undetectable		 4qvyY-2iexA:
21.13
4qvyZ-2iexA:
26.12
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.
4UBE_A_2FAA401_1
(ADENOSINE KINASE)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		5 / 12 SER A  72
ASP A  75
GLY A  74
GLY A  73
ALA A  69
 None
 1.22A 4ubeA-2iexA:
undetectable		 4ubeA-2iexA:
21.96
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.
4XDT_A_ACTA409_0
(FAD:PROTEIN FMN
TRANSFERASE)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		4 / 5 ILE A 208
VAL A  59
ILE A  61
THR A 201
 None
 0.73A 4xdtA-2iexA:
undetectable		 4xdtA-2iexA:
22.25
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.
5BMV_C_VLBC507_2
(TUBULIN ALPHA-1B
CHAIN)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		4 / 7 PRO A  38
VAL A  41
ASN A  42
ILE A  45
 None
 0.43A 5bmvC-2iexA:
undetectable		 5bmvC-2iexA:
20.88
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.
6AG0_A_ACRA606_0
(ALPHA-AMYLASE)		 2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE
(Geobacillus
kaustophilus) 		5 / 7 GLY A 120
GLY A 119
GLY A 143
PRO A 144
GLY A 147
 None
 0.96A 6ag0A-2iexA:
undetectable		 6ag0A-2iexA:
15.41