SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2dxb'

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.
1BU5_B_RBFB302_1
(PROTEIN (FLAVODOXIN))		 2dxb THIOCYANATE
HYDROLASE SUBUNIT
GAMMA
(Thiobacillus
thioparus) 		4 / 8 THR C 185
ASN C 112
ASP C 118
GLY C  85
 None
 0.70A 1bu5B-2dxbC:
undetectable		 1bu5B-2dxbC:
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.
2QK8_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 2dxb THIOCYANATE
HYDROLASE SUBUNIT
GAMMA
(Thiobacillus
thioparus) 		5 / 12 ALA C 179
LEU C 170
PRO C 171
ARG C 160
TYR C 151
 None
 1.05A 2qk8A-2dxbC:
undetectable		 2qk8A-2dxbC:
20.40
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.
4KLA_A_CHDA502_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2dxb THIOCYANATE
HYDROLASE SUBUNIT
GAMMA
(Thiobacillus
thioparus) 		4 / 8 LEU C 168
LEU C 163
LEU C 155
VAL C 189
 None
 0.89A 4klaA-2dxbC:
undetectable		 4klaA-2dxbC:
21.47
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.
4PEV_A_ADNA501_2
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)		 2dxb THIOCYANATE
HYDROLASE SUBUNIT
GAMMA
(Thiobacillus
thioparus) 		3 / 3 PRO C 171
LEU C 170
HIS C 124
 None
 0.72A 4pevA-2dxbC:
undetectable		 4pevA-2dxbC:
18.72
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.
5DV4_A_NMYA601_2
(CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE)		 2dxb THIOCYANATE
HYDROLASE SUBUNIT
GAMMA
(Thiobacillus
thioparus) 		3 / 3 GLU C 165
TRP C 158
ASN C 150
 None
 1.15A 5dv4A-2dxbC:
undetectable		 5dv4A-2dxbC:
19.06
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.
6BEO_A_DHIA4_0
((DPR)PY(DHI)PKDL(DGN
))		 2dxb THIOCYANATE
HYDROLASE SUBUNIT
GAMMA
(Thiobacillus
thioparus) 		3 / 3 TYR C 146
PRO C 135
LEU C 139
 CSO  C 133 ( 4.5A)
None
None
 0.73A 6beoA-2dxbC:
undetectable		 6beoA-2dxbC:
6.32