SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2a4k'

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.
1ERE_E_ESTE600_1
(ESTROGEN RECEPTOR)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		4 / 8 ALA A  14
LEU A  43
LEU A  42
LEU A  50
 None
 0.90A 1ereE-2a4kA:
undetectable		 1ereE-2a4kA:
23.49
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.
1ERE_F_ESTF600_1
(ESTROGEN RECEPTOR)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		4 / 8 ALA A  14
LEU A  43
LEU A  42
LEU A  50
 None
 0.90A 1ereF-2a4kA:
undetectable		 1ereF-2a4kA:
23.49
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.
1N4H_A_REAA500_1
(NUCLEAR RECEPTOR
ROR-BETA)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 11 ALA A  74
VAL A  34
VAL A 118
LEU A 221
ALA A  85
 None
 1.17A 1n4hA-2a4kA:
undetectable		 1n4hA-2a4kA:
23.34
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.
1Q23_J_FUAJ711_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 11 PHE A 116
LEU A 126
VAL A 125
PHE A  71
VAL A  84
 None
 1.41A 1q23J-2a4kA:
undetectable		 1q23J-2a4kA:
18.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UAY_A_ADNA1001_1
(TYPE II
3-HYDROXYACYL-COA
DEHYDROGENASE)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		6 / 11 GLY A  13
ALA A  15
ASP A  37
ASP A  60
VAL A  61
ALA A  88
 None
 0.49A 1uayA-2a4kA:
24.5		 1uayA-2a4kA:
38.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UAY_B_ADNB1002_1
(TYPE II
3-HYDROXYACYL-COA
DEHYDROGENASE)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		6 / 10 GLY A  13
ALA A  15
ASP A  37
ASP A  60
VAL A  61
ALA A  88
 None
 0.48A 1uayB-2a4kA:
24.8		 1uayB-2a4kA:
38.35
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.
2NNI_A_MTKA501_1
(CYTOCHROME P450 2C8)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 SER A  16
ASN A 111
VAL A 213
ALA A 214
VAL A 133
 None
UNX  A 276 (-3.8A)
None
None
None
 0.98A 2nniA-2a4kA:
undetectable		 2nniA-2a4kA:
20.29
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.
2NNI_A_MTKA501_1
(CYTOCHROME P450 2C8)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 SER A  16
VAL A 213
ALA A 214
VAL A  11
VAL A 133
 None
 0.90A 2nniA-2a4kA:
undetectable		 2nniA-2a4kA:
20.29
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.
2NNI_A_MTKA501_1
(CYTOCHROME P450 2C8)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 SER A  16
VAL A 213
ALA A 214
VAL A  11
VAL A 133
 None
 1.24A 2nniA-2a4kA:
undetectable		 2nniA-2a4kA:
20.29
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.
3N8W_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 VAL A  47
LEU A  10
GLY A  13
ALA A  14
LEU A  23
 None
 0.91A 3n8wA-2a4kA:
undetectable		 3n8wA-2a4kA:
19.10
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.
3N8Z_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 VAL A  47
LEU A  10
GLY A  13
ALA A  14
LEU A  23
 None
 0.85A 3n8zA-2a4kA:
undetectable		 3n8zA-2a4kA:
19.10
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 10 LEU A  75
LEU A 126
THR A   8
VAL A  34
VAL A  70
 None
 1.27A 3r9cA-2a4kA:
undetectable		 3r9cA-2a4kA:
22.88
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.
3ROX_A_TEPA266_1
(APOLIPOPROTEIN
A-I-BINDING PROTEIN)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		4 / 8 ALA A  85
VAL A  11
LEU A  33
LEU A 218
 None
 0.84A 3roxA-2a4kA:
5.2		 3roxA-2a4kA:
24.33
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.
4KLR_B_CHDB504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		3 / 3 LEU A 190
PRO A 191
ARG A 239
 None
 0.70A 4klrB-2a4kA:
3.7		 4klrB-2a4kA:
20.57
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.
4LG1_A_SAMA301_0
(PROTEIN-LYSINE
METHYLTRANSFERASE
METTL21D)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 ALA A 226
GLY A 171
GLY A 130
LEU A 126
GLU A 166
 None
 1.07A 4lg1A-2a4kA:
6.9		 4lg1A-2a4kA:
23.44
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.
4LG1_B_SAMB301_0
(PROTEIN-LYSINE
METHYLTRANSFERASE
METTL21D)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 ALA A 226
GLY A 171
GLY A 130
LEU A 126
GLU A 166
 None
 1.12A 4lg1B-2a4kA:
6.9		 4lg1B-2a4kA:
23.44
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.
4M11_B_MXMB606_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 ILE A   9
LEU A  33
ALA A 214
LEU A 218
LEU A 221
 None
 0.93A 4m11B-2a4kA:
undetectable		 4m11B-2a4kA:
19.04
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.
4O1Z_A_MXMA807_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		6 / 12 ILE A   9
ILE A  18
ALA A 214
LEU A 218
LEU A 221
LEU A   4
 None
 1.48A 4o1zA-2a4kA:
undetectable		 4o1zA-2a4kA:
17.66
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.
5E26_A_PAUA602_0
(PANTOTHENATE KINASE
2, MITOCHONDRIAL)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		4 / 7 GLY A 145
ARG A 239
GLY A 140
ALA A 143
 UNX  A 277 ( 4.7A)
None
None
None
 0.88A 5e26A-2a4kA:
undetectable
5e26B-2a4kA:
undetectable		 5e26A-2a4kA:
21.39
5e26B-2a4kA:
21.39
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.
5E26_C_PAUC602_0
(PANTOTHENATE KINASE
2, MITOCHONDRIAL)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		4 / 7 GLY A 145
ARG A 239
GLY A 140
ALA A 143
 UNX  A 277 ( 4.7A)
None
None
None
 0.85A 5e26C-2a4kA:
undetectable
5e26D-2a4kA:
undetectable		 5e26C-2a4kA:
21.39
5e26D-2a4kA:
21.39
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.
5E26_D_PAUD601_0
(PANTOTHENATE KINASE
2, MITOCHONDRIAL)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		4 / 8 ALA A 143
GLY A 145
ARG A 239
GLY A 140
 None
UNX  A 277 ( 4.7A)
None
None
 0.84A 5e26C-2a4kA:
undetectable
5e26D-2a4kA:
undetectable		 5e26C-2a4kA:
21.39
5e26D-2a4kA:
21.39
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.
5O4Y_D_CCSD14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2
PROGRAMMED CELL
DEATH 1 LIGAND 1)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		5 / 12 SER A  16
GLY A  13
GLY A  89
VAL A  90
THR A 135
 None
None
None
UNX  A 276 (-4.8A)
None
 1.03A 5o4yD-2a4kA:
undetectable
5o4yE-2a4kA:
undetectable		 5o4yD-2a4kA:
5.43
5o4yE-2a4kA:
16.92
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.
5W7B_B_PA1B204_1
(ACYLOXYACYL
HYDROLASE SMALL
SUBUNIT
ACYLOXYACYL
HYDROLASE LARGE
SUBUNIT)		 2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE
(Thermus
thermophilus) 		3 / 3 GLY A  89
ASN A 111
ARG A  38
 None
UNX  A 276 (-3.8A)
None
 0.66A 5w7bD-2a4kA:
5.7		 5w7bD-2a4kA:
10.69