SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3tho'

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.
1ICV_B_NIOB702_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 5 PHE B 181
GLY B 179
THR B 229
PHE B 177
 None
 1.26A 1icvA-3thoB:
undetectable
1icvB-3thoB:
undetectable		 1icvA-3thoB:
20.88
1icvB-3thoB:
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.
1RTS_A_D16A309_1
(THYMIDYLATE SYNTHASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 8 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.73A 1rtsA-3thoB:
undetectable		 1rtsA-3thoB:
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.
1RTS_B_D16B409_1
(THYMIDYLATE SYNTHASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 7 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.75A 1rtsB-3thoB:
undetectable		 1rtsB-3thoB:
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.
2AVD_B_SAMB601_1
(CATECHOL-O-METHYLTRA
NSFERASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		3 / 3 SER B  21
GLU B 242
ASP B  14
 None
None
MN  B   1 (-3.7A)
 0.90A 2avdB-3thoB:
undetectable		 2avdB-3thoB:
22.16
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.
2TSR_A_D16A309_1
(THYMIDYLATE SYNTHASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 7 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.77A 2tsrA-3thoB:
undetectable		 2tsrA-3thoB:
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.
2XAD_G_GCSG710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 8 HIS B  16
ASP B  58
HIS B 218
ASP B  14
 MN  B   1 (-3.9A)
MN  B   2 ( 2.5A)
MN  B   1 (-3.9A)
MN  B   1 (-3.7A)
 1.11A 2xadC-3thoB:
undetectable		 2xadC-3thoB:
20.82
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.
2XF3_A_J01A500_1
(ORF12)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 10 HIS B  16
ILE B 236
LEU B  60
LEU B  34
GLY B  18
 MN  B   1 (-3.9A)
None
None
None
None
 1.17A 2xf3A-3thoB:
undetectable		 2xf3A-3thoB:
22.98
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.
3A6J_F_CRNF307_1
(CREATININE
AMIDOHYDROLASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 8 HIS B  16
ASP B  58
HIS B 216
TYR B 231
HIS B 218
 MN  B   1 (-3.9A)
MN  B   2 ( 2.5A)
MN  B   2 ( 3.0A)
None
MN  B   1 (-3.9A)
 1.49A 3a6jF-3thoB:
undetectable		 3a6jF-3thoB:
23.04
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.
3RET_A_SALA201_1
(SALICYLATE
BIOSYNTHESIS PROTEIN
PCHB)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 10 VAL B  41
ARG B  48
VAL B  50
ILE B  53
ILE B 265
 None
 1.42A 3retA-3thoB:
2.0
3retB-3thoB:
undetectable		 3retA-3thoB:
14.25
3retB-3thoB:
14.25
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.
4DO3_A_0LAA602_1
(FATTY-ACID AMIDE
HYDROLASE 1)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 5 LEU B  17
LEU B  38
MET B  81
THR B  12
 None
 1.46A 4do3A-3thoB:
undetectable		 4do3A-3thoB:
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.
4G1B_C_ECNC403_1
(FLAVOHEMOGLOBIN)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 9 ILE B 176
LEU B  54
VAL B  88
VAL B  50
LEU B  52
 None
 1.10A 4g1bC-3thoB:
undetectable		 4g1bC-3thoB:
23.93
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_ACTA407_0
(FAD:PROTEIN FMN
TRANSFERASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		3 / 3 ASP B 312
GLY B 308
ASP B 306
 None
 0.70A 4xdtA-3thoB:
undetectable		 4xdtA-3thoB:
23.47
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.
4YVP_B_GBMB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C1)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 12 LEU B  55
VAL B  87
ILE B 113
LEU B  60
LEU B  99
 None
 1.19A 4yvpB-3thoB:
undetectable		 4yvpB-3thoB:
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.
5H3A_A_D16A401_1
(ORF70)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 7 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.84A 5h3aA-3thoB:
undetectable		 5h3aA-3thoB:
20.48
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.
5H3A_B_D16B401_1
(ORF70)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 7 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.83A 5h3aB-3thoB:
undetectable		 5h3aB-3thoB:
20.48
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.
5MQT_C_STIC302_1
(DEOXYCYTIDINE KINASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 12 ILE B 265
VAL B  50
MET B  81
LEU B  55
GLU B  44
 None
 1.28A 5mqtC-3thoB:
undetectable		 5mqtC-3thoB:
25.19
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.
5NOO_A_D16A402_1
(THYMIDYLATE SYNTHASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 7 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.80A 5nooA-3thoB:
undetectable		 5nooA-3thoB:
21.35
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.
5TT3_B_EZLB303_1
(ALPHA-CARBONIC
ANHYDRASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 9 HIS B  11
VAL B 252
VAL B 250
LEU B 228
ALA B 212
 None
 1.45A 5tt3B-3thoB:
undetectable		 5tt3B-3thoB:
20.16
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.
5WWS_B_SAMB501_0
(PUTATIVE
METHYLTRANSFERASE
NSUN6)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 12 PRO B 232
GLY B 248
LYS B 247
ILE B 223
ASP B 245
 None
 1.12A 5wwsB-3thoB:
undetectable		 5wwsB-3thoB:
22.78
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.
5X5Q_C_D16C402_1
(THYMIDYLATE SYNTHASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 7 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.71A 5x5qC-3thoB:
undetectable		 5x5qC-3thoB:
20.98
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.
5X5Q_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 8 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.69A 5x5qD-3thoB:
undetectable		 5x5qD-3thoB:
20.98
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.
5X5Q_F_D16F402_1
(THYMIDYLATE SYNTHASE)		 3tho EXONUCLEASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 8 ILE B 230
ASP B  14
GLY B 233
PHE B 220
 None
MN  B   1 (-3.7A)
None
None
 0.69A 5x5qF-3thoB:
undetectable		 5x5qF-3thoB:
20.98