SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4o1i'

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.
2AOH_C_FRDC305_1
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 4o1i TRANSCRIPTIONAL
REGULATORY PROTEIN
(Mycobacterium
tuberculosis) 		4 / 5 LEU A   4
GLY A 113
PRO A  72
ALA A  45
 None
 0.96A 2aohA-4o1iA:
undetectable		 2aohA-4o1iA:
25.23
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.
2AVD_B_SAMB601_0
(CATECHOL-O-METHYLTRA
NSFERASE)		 4o1i TRANSCRIPTIONAL
REGULATORY PROTEIN
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  57
VAL A  85
ALA A  75
ASP A  53
ALA A  50
 None
 1.39A 2avdB-4o1iA:
3.0		 2avdB-4o1iA:
23.66
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.
2NNK_A_ROCA401_3
(PROTEASE)		 4o1i TRANSCRIPTIONAL
REGULATORY PROTEIN
(Mycobacterium
tuberculosis) 		5 / 12 LEU A   7
GLY A  59
GLY A  90
VAL A  46
VAL A  48
 None
 0.96A 2nnkB-4o1iA:
undetectable		 2nnkB-4o1iA:
22.64
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.
2OUZ_A_C3DA999_0
(ESTROGEN RECEPTOR)		 4o1i TRANSCRIPTIONAL
REGULATORY PROTEIN
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  64
LEU A  47
ILE A 104
HIS A  25
LEU A   4
 None
 0.94A 2ouzA-4o1iA:
undetectable		 2ouzA-4o1iA:
18.65
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.
3CWK_A_REAA300_1
(CELLULAR RETINOIC
ACID-BINDING PROTEIN
2)		 4o1i TRANSCRIPTIONAL
REGULATORY PROTEIN
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  37
ALA A  40
ALA A  43
VAL A 112
VAL A  46
 None
 1.25A 3cwkA-4o1iA:
undetectable		 3cwkA-4o1iA:
19.46
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.
6ECT_A_SAMA1300_0
(STIE PROTEIN)		 4o1i TRANSCRIPTIONAL
REGULATORY PROTEIN
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  63
GLY A  57
GLY A  59
VAL A  48
LEU A   7
 None
 1.03A 6ectA-4o1iA:
undetectable		 6ectA-4o1iA:
21.57