SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ios'

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.
1NH8_A_HISA289_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 3ios DISULFIDE BOND
FORMING PROTEIN
(DSBF)
(Mycobacterium
tuberculosis) 		4 / 5 ASP A 153
LEU A  50
ALA A  72
LEU A 177
 None
 0.90A 1nh8A-3iosA:
undetectable		 1nh8A-3iosA:
22.19
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.
1Q23_H_FUAH709_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 3ios DISULFIDE BOND
FORMING PROTEIN
(DSBF)
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 170
VAL A 174
PHE A 103
VAL A  91
VAL A 152
 None
 1.20A 1q23H-3iosA:
undetectable
1q23I-3iosA:
undetectable		 1q23H-3iosA:
21.92
1q23I-3iosA:
21.92
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.
2X2I_A_QPSA1060_1
(ALPHA-1,4-GLUCAN
LYASE ISOZYME 1)		 3ios DISULFIDE BOND
FORMING PROTEIN
(DSBF)
(Mycobacterium
tuberculosis) 		5 / 12 PHE A 118
TRP A  75
VAL A  91
GLY A  92
ALA A  88
 None
 1.19A 2x2iA-3iosA:
undetectable		 2x2iA-3iosA:
8.57
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.
2X2I_C_QPSC1060_1
(ALPHA-1,4-GLUCAN
LYASE ISOZYME 1)		 3ios DISULFIDE BOND
FORMING PROTEIN
(DSBF)
(Mycobacterium
tuberculosis) 		5 / 12 PHE A 118
TRP A  75
VAL A  91
GLY A  92
ALA A  88
 None
 1.24A 2x2iC-3iosA:
undetectable		 2x2iC-3iosA:
8.57
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.
3KP6_B_SALB3008_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 3ios DISULFIDE BOND
FORMING PROTEIN
(DSBF)
(Mycobacterium
tuberculosis) 		4 / 7 VAL A 119
GLN A 116
VAL A 112
ALA A 131
 None
 1.04A 3kp6B-3iosA:
undetectable		 3kp6B-3iosA:
22.02
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.
3L8L_D_DVAD6_0
(GRAMICIDIN D)		 3ios DISULFIDE BOND
FORMING PROTEIN
(DSBF)
(Mycobacterium
tuberculosis) 		3 / 3 TRP A 138
ALA A 131
VAL A 106
 None
 1.00A 3l8lC-3iosA:
undetectable
3l8lD-3iosA:
undetectable		 3l8lC-3iosA:
7.34
3l8lD-3iosA:
10.09
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.
4J7X_B_SASB804_1
(SEPIAPTERIN
REDUCTASE)		 3ios DISULFIDE BOND
FORMING PROTEIN
(DSBF)
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  50
PHE A 141
ALA A  54
GLY A 105
LEU A 130
 None
 1.26A 4j7xB-3iosA:
2.5		 4j7xB-3iosA:
22.35
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.
5D4N_C_ACTC201_0
(NITROGEN REGULATORY
PROTEIN P-II)		 3ios DISULFIDE BOND
FORMING PROTEIN
(DSBF)
(Mycobacterium
tuberculosis) 		4 / 5 VAL A 137
VAL A 143
GLY A 142
PHE A  76
 None
 1.00A 5d4nA-3iosA:
undetectable
5d4nC-3iosA:
undetectable		 5d4nA-3iosA:
19.44
5d4nC-3iosA:
19.44