SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3hrx'

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.
1GTI_B_CCSB47_0
(GLUTATHIONE
S-TRANSFERASE)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		5 / 7 LEU A  28
THR A  25
GLY A  60
LEU A 109
TYR A  80
 None
 1.40A 1gtiB-3hrxA:
undetectable		 1gtiB-3hrxA:
23.17
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.
1GTI_B_CCSB47_0
(GLUTATHIONE
S-TRANSFERASE)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		4 / 7 LEU A  50
LEU A 111
GLY A 113
LEU A  87
 None
 0.86A 1gtiB-3hrxA:
undetectable		 1gtiB-3hrxA:
23.17
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.
1HWK_B_117B1_1
(HMG-COA REDUCTASE)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		5 / 11 GLU A 154
SER A 163
LEU A 162
ALA A 167
LEU A 172
 None
 1.49A 1hwkA-3hrxA:
undetectable		 1hwkA-3hrxA:
20.00
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.
1R9O_A_FLPA501_1
(CYTOCHROME P450 2C9)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		5 / 12 LEU A  15
VAL A  96
GLY A 106
ALA A 105
LEU A  29
 None
 1.08A 1r9oA-3hrxA:
undetectable		 1r9oA-3hrxA:
19.42
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.
2VQY_A_PARA1201_1
(AAC(6')-IB)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		5 / 12 GLY A  52
LEU A  87
VAL A  83
TYR A  80
SER A 137
 None
 1.46A 2vqyA-3hrxA:
undetectable		 2vqyA-3hrxA:
23.79
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.
3LP1_A_NVPA701_1
(REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		5 / 10 LEU A  15
ASN A  99
VAL A  98
GLY A 100
LEU A  50
 None
 1.28A 3lp1A-3hrxA:
2.0		 3lp1A-3hrxA:
18.75
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.
3TPX_E_ACTE204_0
(E3 UBIQUITIN-PROTEIN
LIGASE MDM2)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		3 / 3 LYS A  92
PRO A  93
LEU A  94
 None
 0.85A 3tpxE-3hrxA:
undetectable		 3tpxE-3hrxA:
18.49
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.
4E1G_A_LNLA701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		6 / 12 ASN A  99
GLY A  60
ALA A  23
SER A  58
GLY A  52
LEU A  15
 None
 1.38A 4e1gA-3hrxA:
undetectable		 4e1gA-3hrxA:
16.99
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.
4M48_A_21BA704_1
(TRANSPORTER)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		4 / 8 PHE A  57
VAL A   2
SER A  58
GLY A  52
 None
 0.84A 4m48A-3hrxA:
undetectable		 4m48A-3hrxA:
17.42
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.
4RJD_B_TFPB204_1
(CALMODULIN)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		4 / 8 LEU A  36
GLY A  39
GLU A  40
ALA A 194
 None
 0.89A 4rjdA-3hrxA:
undetectable
4rjdB-3hrxA:
undetectable		 4rjdA-3hrxA:
13.69
4rjdB-3hrxA:
13.69
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.
5FPD_B_PZAB1385_0
(HEAT SHOCK-RELATED
70KDA PROTEIN 2)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		4 / 7 ASN A  99
VAL A  98
ALA A 110
GLY A 106
 None
 0.85A 5fpdB-3hrxA:
undetectable		 5fpdB-3hrxA:
21.34
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.
5KR1_B_017B101_2
(PROTEASE PR5-DRV)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		4 / 8 ASN A  99
GLY A 100
VAL A  96
GLY A 106
 None
 0.54A 5kr1B-3hrxA:
undetectable		 5kr1B-3hrxA:
17.81
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.
5ND7_B_TA1B601_2
(TUBULIN BETA-2B
CHAIN)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		3 / 3 THR A 233
PRO A 249
ARG A 250
 None
 0.85A 5nd7B-3hrxA:
undetectable		 5nd7B-3hrxA:
20.74
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.
5YW0_A_ACTA411_0
(UNCHARACTERIZED
PROTEIN KDOO)		 3hrx PROBABLE ENOYL-COA
HYDRATASE
(Thermus
thermophilus) 		3 / 3 LYS A   4
LEU A  11
ARG A   6
 None
 0.87A 5yw0A-3hrxA:
undetectable		 5yw0A-3hrxA:
23.82