SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3doh'

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.
1E7A_A_PFLA4002_1
(SERUM ALBUMIN)		 3doh ESTERASE
(Thermotoga
maritima) 		3 / 3 PHE A 116
LEU A 245
SER A 286
 SO4  A 400 (-4.6A)
None
SO4  A 400 (-2.5A)
 0.59A 1e7aA-3dohA:
undetectable		 1e7aA-3dohA:
23.23
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.
1JHO_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 9 GLY A 199
LEU A 285
GLU A 200
ARG A 201
GLY A 288
 SO4  A 400 (-4.3A)
None
SO4  A 400 ( 4.3A)
None
None
 1.25A 1jhoA-3dohA:
2.7		 1jhoA-3dohA:
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.
1JHR_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 9 GLY A 199
LEU A 285
GLU A 200
ARG A 201
GLY A 288
 SO4  A 400 (-4.3A)
None
SO4  A 400 ( 4.3A)
None
None
 1.30A 1jhrA-3dohA:
3.5		 1jhrA-3dohA:
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.
1L5K_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 9 GLY A 199
LEU A 285
GLU A 200
ARG A 201
GLY A 288
 SO4  A 400 (-4.3A)
None
SO4  A 400 ( 4.3A)
None
None
 1.29A 1l5kA-3dohA:
undetectable		 1l5kA-3dohA:
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.
1L5L_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 9 GLY A 199
LEU A 285
GLU A 200
ARG A 201
GLY A 288
 SO4  A 400 (-4.3A)
None
SO4  A 400 ( 4.3A)
None
None
 1.31A 1l5lA-3dohA:
2.4		 1l5lA-3dohA:
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.
1OIP_A_VIVA1278_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 12 LEU A 130
ILE A  42
LEU A  53
VAL A  96
ILE A  48
 None
 0.86A 1oipA-3dohA:
3.9		 1oipA-3dohA:
19.49
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.
1R15_C_NCAC339_0
(ADP-RIBOSYL CYCLASE)		 3doh ESTERASE
(Thermotoga
maritima) 		3 / 3 GLU A 385
ASN A 383
TRP A 327
 None
 1.05A 1r15C-3dohA:
undetectable		 1r15C-3dohA:
22.22
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.
1R15_D_NCAD349_0
(ADP-RIBOSYL CYCLASE)		 3doh ESTERASE
(Thermotoga
maritima) 		3 / 3 GLU A 385
ASN A 383
TRP A 327
 None
 1.07A 1r15D-3dohA:
undetectable		 1r15D-3dohA:
22.22
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.
1R15_E_NCAE359_0
(ADP-RIBOSYL CYCLASE)		 3doh ESTERASE
(Thermotoga
maritima) 		3 / 3 GLU A 385
ASN A 383
TRP A 327
 None
 1.05A 1r15E-3dohA:
undetectable		 1r15E-3dohA:
22.22
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.
1XF1_A_ACTA1107_0
(C5A PEPTIDASE)		 3doh ESTERASE
(Thermotoga
maritima) 		4 / 5 LEU A  53
GLY A  50
ILE A  48
PHE A 134
 None
 0.81A 1xf1A-3dohA:
1.9		 1xf1A-3dohA:
18.74
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.
1XF1_B_ACTB1108_0
(C5A PEPTIDASE)		 3doh ESTERASE
(Thermotoga
maritima) 		4 / 6 LEU A  53
GLY A  50
ILE A  48
PHE A 134
 None
 0.79A 1xf1B-3dohA:
2.1		 1xf1B-3dohA:
18.74
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.
2BNN_B_FCNB1199_1
(EPOXIDASE)		 3doh ESTERASE
(Thermotoga
maritima) 		4 / 8 LEU A 207
GLU A  35
HIS A 153
ALA A 210
 None
None
SO4  A 404 (-3.6A)
None
 0.97A 2bnnA-3dohA:
undetectable
2bnnB-3dohA:
undetectable		 2bnnA-3dohA:
21.16
2bnnB-3dohA:
21.16
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.
2EJF_A_ADNA2001_1
(235AA LONG
HYPOTHETICAL
BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 3doh ESTERASE
(Thermotoga
maritima) 		4 / 7 ARG A 357
ALA A 305
PRO A 308
ALA A 306
 None
 1.03A 2ejfA-3dohA:
undetectable		 2ejfA-3dohA:
20.42
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.
2FR3_A_REAA300_1
(CELLULAR RETINOIC
ACID BINDING PROTEIN
2)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 12 ILE A 280
ALA A 306
PRO A 308
THR A 292
LEU A 349
 None
 1.08A 2fr3A-3dohA:
undetectable		 2fr3A-3dohA:
17.58
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.
3JB3_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 12 GLY A 214
ALA A 233
ALA A 219
VAL A 217
PRO A  32
 None
 1.06A 3jb3A-3dohA:
undetectable		 3jb3A-3dohA:
16.50
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.
4DR2_A_PARA1609_1
(16S RRNA
30S RIBOSOMAL
PROTEIN S9
30S RIBOSOMAL
PROTEIN S10)		 3doh ESTERASE
(Thermotoga
maritima) 		3 / 3 TYR A 281
ARG A 279
SER A 394
 None
 1.17A 4dr2I-3dohA:
undetectable
4dr2J-3dohA:
undetectable		 4dr2I-3dohA:
15.00
4dr2J-3dohA:
13.95
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.
4KQI_A_NIOA403_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 9 GLY A 199
LEU A 285
GLU A 200
ARG A 201
GLY A 288
 SO4  A 400 (-4.3A)
None
SO4  A 400 ( 4.3A)
None
None
 1.35A 4kqiA-3dohA:
3.4		 4kqiA-3dohA:
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.
4XUD_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 12 VAL A 192
GLY A 284
TYR A 281
SER A 286
TRP A 242
 None
None
None
SO4  A 400 (-2.5A)
None
 1.50A 4xudA-3dohA:
3.0		 4xudA-3dohA:
19.53
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.
5FCT_B_C2FB402_1
(THYMIDYLATE SYNTHASE)		 3doh ESTERASE
(Thermotoga
maritima) 		3 / 3 ASN A 118
ASP A 372
GLY A 375
 None
 0.57A 5fctB-3dohA:
undetectable		 5fctB-3dohA:
21.55
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.
5QH1_A_ACTA301_0
(PEROXISOMAL COENZYME
A DIPHOSPHATASE
NUDT7)		 3doh ESTERASE
(Thermotoga
maritima) 		3 / 3 VAL A  60
VAL A 127
GLN A 148
 None
 0.72A 5qh1A-3dohA:
undetectable		 5qh1A-3dohA:
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.
5TIW_B_OAQB302_0
(SULFOTRANSFERASE)		 3doh ESTERASE
(Thermotoga
maritima) 		5 / 12 PRO A 234
ILE A 280
LEU A 195
VAL A 262
PHE A 303
 None
 1.31A 5tiwB-3dohA:
undetectable		 5tiwB-3dohA:
21.41
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.
5V5Z_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3doh ESTERASE
(Thermotoga
maritima) 		3 / 3 GLY A 288
THR A 163
PRO A 234
 None
 0.53A 5v5zA-3dohA:
undetectable		 5v5zA-3dohA:
23.35