SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2cwl'

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.
1JTV_A_TESA500_1
(17
BETA-HYDROXYSTEROID
DEHYDROGENASE TYPE 1)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		4 / 8 VAL A 262
HIS A 188
VAL A 187
GLU A  69
 None
 1.09A 1jtvA-2cwlA:
undetectable		 1jtvA-2cwlA:
22.60
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.
1N2X_A_SAMA401_0
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 12 HIS A  73
GLU A  36
GLY A 185
VAL A 138
ASN A  49
 None
 1.26A 1n2xA-2cwlA:
undetectable		 1n2xA-2cwlA:
20.86
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.
1RNR_B_DAHB208_1
(RIBONUCLEOTIDE
REDUCTASE R1 PROTEIN)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 12 HIS A 188
TYR A 192
GLU A  36
ILE A  66
GLU A  70
 None
 1.02A 1rnrB-2cwlA:
8.6		 1rnrB-2cwlA:
23.26
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.
2ADM_A_SAMA500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 11 GLU A  94
ALA A 279
GLU A 280
ALA A 121
PRO A 103
 None
 1.22A 2admA-2cwlA:
undetectable		 2admA-2cwlA:
21.99
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.
2ADM_B_SAMB500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 11 GLU A  94
ALA A 279
GLU A 280
ALA A 121
PRO A 103
 None
 1.23A 2admB-2cwlA:
undetectable		 2admB-2cwlA:
21.99
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.
2RLC_A_CHDA332_0
(CHOLOYLGLYCINE
HYDROLASE)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 12 ILE A 178
ALA A  25
ASN A  82
THR A  80
LEU A  84
 None
 1.07A 2rlcA-2cwlA:
undetectable		 2rlcA-2cwlA:
22.31
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.
2WEK_A_DIFA1376_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		4 / 8 TYR A 192
LEU A  62
ALA A  64
HIS A 188
 None
 1.02A 2wekA-2cwlA:
undetectable		 2wekA-2cwlA:
23.40
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.
3A7E_A_SAMA216_1
(CATECHOL
O-METHYLTRANSFERASE)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		4 / 6 ILE A 178
GLU A 220
ILE A 218
ASP A 170
 None
 0.80A 3a7eA-2cwlA:
undetectable		 3a7eA-2cwlA:
20.13
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.
3HY7_A_097A801_1
(A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 5)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 9 LEU A  40
HIS A  73
GLU A  36
HIS A 188
LEU A  71
 None
 1.33A 3hy7A-2cwlA:
undetectable		 3hy7A-2cwlA:
22.96
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.
3HY7_B_097B801_1
(A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 5)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 9 LEU A  40
HIS A  73
GLU A  36
HIS A 188
LEU A  71
 None
 1.24A 3hy7B-2cwlA:
undetectable		 3hy7B-2cwlA:
22.96
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.
3KK6_B_CELB1701_2
(PROSTAGLANDIN G/H
SYNTHASE 1)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		4 / 6 VAL A 125
LEU A  12
ALA A  78
LEU A  30
 None
 0.88A 3kk6B-2cwlA:
undetectable		 3kk6B-2cwlA:
19.81
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.
3RUK_D_AERD601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 11 ALA A 121
TYR A 291
ASP A 277
GLY A 275
ALA A 274
 None
 1.17A 3rukD-2cwlA:
undetectable		 3rukD-2cwlA:
19.88
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.
4NPT_A_017A401_1
(PROTEASE)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 9 ALA A  28
ILE A  81
ILE A  74
ILE A 178
VAL A 165
 None
 1.15A 4nptA-2cwlA:
undetectable		 4nptA-2cwlA:
17.63
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.
4R1Z_A_AERA601_1
(CYP17A1 PROTEIN)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 9 ALA A 121
TYR A 291
ASP A 277
GLY A 275
ALA A 274
 None
 1.17A 4r1zA-2cwlA:
undetectable		 4r1zA-2cwlA:
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.
4ZAU_A_YY3A1101_1
(EPIDERMAL GROWTH
FACTOR RECEPTOR)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		5 / 8 LEU A  76
GLY A  72
ALA A  79
LEU A  12
GLY A 269
 None
 0.99A 4zauA-2cwlA:
undetectable		 4zauA-2cwlA:
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.
5JLC_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		4 / 5 TYR A 224
GLY A 179
GLY A 275
LEU A   8
 None
 0.86A 5jlcA-2cwlA:
undetectable		 5jlcA-2cwlA:
22.24
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.
5XU8_A_DX4A701_0
(UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 2)		 2cwl MANGANESE-FREE
PSEUDOCATALASE
(Thermus
thermophilus) 		4 / 8 GLY A 179
LEU A 182
ASN A 215
SER A 216
 None
 0.88A 5xu8A-2cwlA:
undetectable		 5xu8A-2cwlA:
22.31