SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1tht'

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.
2ITZ_A_IREA2021_2
(EPIDERMAL GROWTH
FACTOR RECEPTOR)		 1tht THIOESTERASE
(Vibrio
harveyi) 		3 / 3 LEU A 141
LEU A 193
MET A 222
 None
 0.65A 2itzA-1thtA:
undetectable		 2itzA-1thtA:
19.25
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.
2OD9_A_NCAA3721_0
(NAD-DEPENDENT
DEACETYLASE HST2)		 1tht THIOESTERASE
(Vibrio
harveyi) 		3 / 3 PHE A  44
PHE A  84
PHE A 177
 None
 0.85A 2od9A-1thtA:
3.1		 2od9A-1thtA:
21.26
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.
2QD3_B_CHDB504_0
(FERROCHELATASE)		 1tht THIOESTERASE
(Vibrio
harveyi) 		4 / 6 ILE A 297
ARG A 300
PRO A  26
SER A  59
 None
 1.30A 2qd3B-1thtA:
3.5		 2qd3B-1thtA:
22.28
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.
2QQG_A_NCAA3721_0
(NAD-DEPENDENT
DEACETYLASE HST2)		 1tht THIOESTERASE
(Vibrio
harveyi) 		3 / 3 PHE A  44
PHE A  84
PHE A 177
 None
 0.85A 2qqgA-1thtA:
3.1		 2qqgA-1thtA:
21.26
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.
2ZJ0_A_2FAA500_2
(ADENOSYLHOMOCYSTEINA
SE)		 1tht THIOESTERASE
(Vibrio
harveyi) 		4 / 5 GLN A 101
THR A 105
HIS A  10
LEU A  12
 None
 1.39A 2zj0A-1thtA:
6.5		 2zj0A-1thtA:
21.33
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.
3BF1_B_PAUB248_0
(TYPE III
PANTOTHENATE KINASE)		 1tht THIOESTERASE
(Vibrio
harveyi) 		5 / 12 LEU A 100
THR A  37
VAL A  22
VAL A  65
ILE A 108
 None
 1.23A 3bf1A-1thtA:
undetectable
3bf1B-1thtA:
undetectable		 3bf1A-1thtA:
20.26
3bf1B-1thtA:
20.26
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.
3JB2_A_SAMA1101_1
(STRUCTURAL PROTEIN
VP3)		 1tht THIOESTERASE
(Vibrio
harveyi) 		3 / 3 GLU A 122
ASP A 126
ASP A 194
 None
 0.77A 3jb2A-1thtA:
undetectable		 3jb2A-1thtA:
15.95
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.
3V4T_A_ACTA503_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 1tht THIOESTERASE
(Vibrio
harveyi) 		3 / 3 ARG A  67
GLU A  24
THR A   7
 None
 0.92A 3v4tA-1thtA:
0.0		 3v4tA-1thtA:
22.17
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.
4EYZ_A_CCSA109_0
(CELLULOSOME-RELATED
PROTEIN MODULE FROM
RUMINOCOCCUS
FLAVEFACIENS THAT
RESEMBLES
PAPAIN-LIKE CYSTEINE
PEPTIDASES)		 1tht THIOESTERASE
(Vibrio
harveyi) 		4 / 8 PHE A 206
VAL A 257
ILE A 111
ALA A 120
 None
 1.01A 4eyzA-1thtA:
undetectable		 4eyzA-1thtA:
21.97
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.
4EYZ_B_CCSB109_0
(CELLULOSOME-RELATED
PROTEIN MODULE FROM
RUMINOCOCCUS
FLAVEFACIENS THAT
RESEMBLES
PAPAIN-LIKE CYSTEINE
PEPTIDASES)		 1tht THIOESTERASE
(Vibrio
harveyi) 		4 / 8 PHE A 206
VAL A 257
ILE A 111
ALA A 120
 None
 1.00A 4eyzB-1thtA:
undetectable		 4eyzB-1thtA:
21.97
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.
4K6I_A_9RAA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1tht THIOESTERASE
(Vibrio
harveyi) 		5 / 12 ILE A 111
ALA A 113
ALA A 135
ILE A 204
ALA A 117
 None
 1.10A 4k6iA-1thtA:
undetectable		 4k6iA-1thtA:
23.05
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.
4Y0Q_A_PX9A201_0
(BETA-LACTOGLOBULIN)		 1tht THIOESTERASE
(Vibrio
harveyi) 		5 / 12 VAL A 138
LEU A 165
VAL A 178
LEU A 154
MET A  86
 None
 0.98A 4y0qA-1thtA:
undetectable		 4y0qA-1thtA:
20.21
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.
5HRQ_I_IPHI101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 1tht THIOESTERASE
(Vibrio
harveyi) 		4 / 6 VAL A  22
HIS A  10
LEU A  12
LEU A 100
 None
 0.82A 5hrqB-1thtA:
undetectable
5hrqI-1thtA:
undetectable
5hrqJ-1thtA:
undetectable		 5hrqB-1thtA:
7.97
5hrqI-1thtA:
5.26
5hrqJ-1thtA:
7.97
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.
5UTU_H_ADNH503_2
(ADENOSYLHOMOCYSTEINA
SE)		 1tht THIOESTERASE
(Vibrio
harveyi) 		4 / 5 THR A 105
GLU A  24
HIS A  21
LEU A  12
 None
 1.05A 5utuH-1thtA:
6.5		 5utuH-1thtA:
20.53
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.
6A5Z_D_9CRD501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1tht THIOESTERASE
(Vibrio
harveyi) 		5 / 12 ILE A 111
ALA A 113
ALA A 135
ILE A 204
ALA A 117
 None
 1.17A 6a5zD-1thtA:
undetectable		 6a5zD-1thtA:
13.91
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.
6F3N_B_ADNB505_2
(-)		 1tht THIOESTERASE
(Vibrio
harveyi) 		4 / 4 GLN A 101
THR A 105
HIS A  10
LEU A  12
 None
 1.49A 6f3nB-1thtA:
7.5		 6f3nB-1thtA:
22.29