SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2hk3'

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.
1HWK_A_117A2_1
(HMG-COA REDUCTASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 8 SER A 143
SER A  33
ASN A  31
LYS A  21
 None
 1.15A 1hwkA-2hk3A:
3.3		 1hwkA-2hk3A:
21.28
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.
1HWK_C_117C4_1
(HMG-COA REDUCTASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 8 SER A 143
SER A  33
ASN A  31
LYS A  21
 None
 1.18A 1hwkC-2hk3A:
1.9		 1hwkC-2hk3A:
21.28
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.
1HWK_D_117D3_2
(HMG-COA REDUCTASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 8 SER A 143
SER A  33
ASN A  31
LYS A  21
 None
 1.19A 1hwkD-2hk3A:
2.5		 1hwkD-2hk3A:
21.28
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.
1K5Q_B_PACB559_0
(PENICILLIN G ACYLASE
ALPHA SUBUNIT
PENICILLIN G ACYLASE
BETA SUBUNIT)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 7 SER A 132
ALA A 142
SER A 162
ALA A 164
 None
 0.81A 1k5qA-2hk3A:
undetectable
1k5qB-2hk3A:
undetectable		 1k5qA-2hk3A:
23.56
1k5qB-2hk3A:
20.39
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.
1Q23_A_FUAA702_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		6 / 12 THR A  43
PHE A  41
SER A 109
PHE A 180
ALA A 101
ALA A 102
 None
 1.40A 1q23A-2hk3A:
undetectable
1q23B-2hk3A:
undetectable		 1q23A-2hk3A:
21.82
1q23B-2hk3A:
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.
2ACL_E_REAE504_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		5 / 11 ILE A 323
ALA A 112
ALA A 115
LEU A 134
ALA A 142
 None
 1.07A 2aclE-2hk3A:
undetectable		 2aclE-2hk3A:
22.19
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.
2BFP_D_H4BD1290_1
(PTERIDINE REDUCTASE
1)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 8 PHE A 180
ASP A 283
LEU A  15
LEU A 291
 None
 1.02A 2bfpD-2hk3A:
undetectable		 2bfpD-2hk3A:
20.40
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.
2Y01_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		5 / 12 LEU A 257
VAL A 258
THR A 281
SER A 316
PHE A  41
 None
 1.48A 2y01B-2hk3A:
undetectable		 2y01B-2hk3A:
21.01
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.
3ADX_A_IMNA2_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 7 ILE A  34
LEU A 167
PHE A 150
LEU A  38
 None
 0.84A 3adxA-2hk3A:
undetectable		 3adxA-2hk3A:
22.54
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.
3K4V_B_ROCB201_4
(HIV-1 PROTEASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 4 ARG A 200
ASP A 283
GLY A 240
THR A 246
 None
 1.34A 3k4vB-2hk3A:
undetectable		 3k4vB-2hk3A:
16.46
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.
3PFG_A_SAMA264_0
(N-METHYLTRANSFERASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		5 / 12 ALA A 151
GLY A 149
LEU A 167
SER A 169
SER A  35
 None
 1.34A 3pfgA-2hk3A:
undetectable		 3pfgA-2hk3A:
21.32
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.
3PGH_B_FLPB701_1
(CYCLOOXYGENASE-2)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		5 / 11 LEU A 122
LEU A 134
VAL A  47
GLY A   5
ALA A 117
 None
 1.18A 3pghB-2hk3A:
undetectable		 3pghB-2hk3A:
19.02
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.
3THR_A_C2FA1100_1
(GLYCINE
N-METHYLTRANSFERASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		3 / 3 LEU A1002
HIS A1000
MET A1001
 None
 0.89A 3thrD-2hk3A:
undetectable		 3thrD-2hk3A:
21.45
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.
3UJ7_A_SAMA301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		5 / 12 LEU A 167
ILE A  34
ILE A 236
ASP A 226
ALA A 223
 None
 1.38A 3uj7A-2hk3A:
undetectable		 3uj7A-2hk3A:
22.19
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.
4LV9_A_20JA602_1
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 7 TYR A 111
ILE A 146
ILE A 323
ALA A   9
 None
 0.88A 4lv9A-2hk3A:
undetectable		 4lv9A-2hk3A:
22.51
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.
4PAE_A_NIZA804_1
(CATALASE-PEROXIDASE)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 6 PHE A 180
ASP A 283
LEU A 104
THR A  11
 None
 1.23A 4paeA-2hk3A:
undetectable		 4paeA-2hk3A:
18.18
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.
4TWD_F_377F402_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 8 ALA A 105
ALA A 142
SER A 145
ALA A 110
 None
 0.67A 4twdF-2hk3A:
undetectable
4twdG-2hk3A:
1.3
4twdH-2hk3A:
undetectable
4twdI-2hk3A:
undetectable
4twdJ-2hk3A:
undetectable		 4twdF-2hk3A:
22.04
4twdG-2hk3A:
22.04
4twdH-2hk3A:
22.04
4twdI-2hk3A:
22.04
4twdJ-2hk3A:
22.04
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.
4TWD_F_377F402_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 8 ALA A 105
ALA A 142
SER A 145
ALA A 110
 None
 0.77A 4twdF-2hk3A:
undetectable
4twdG-2hk3A:
1.3
4twdH-2hk3A:
undetectable
4twdI-2hk3A:
undetectable
4twdJ-2hk3A:
undetectable		 4twdF-2hk3A:
22.04
4twdG-2hk3A:
22.04
4twdH-2hk3A:
22.04
4twdI-2hk3A:
22.04
4twdJ-2hk3A:
22.04
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.
5JHD_E_EDTE301_0
(BETA-2-MICROGLOBULIN
TCRBETA CHAIN)		 2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE
(Staphylococcus
aureus) 		4 / 8 SER A  94
THR A  45
THR A  43
ILE A  73
 None
 1.08A 5jhdE-2hk3A:
undetectable
5jhdG-2hk3A:
undetectable		 5jhdE-2hk3A:
20.83
5jhdG-2hk3A:
15.09