SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2i6u'

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.
1H9Z_A_RWFA3001_1
(SERUM ALBUMIN)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 11 ALA A 218
LEU A 221
LEU A 247
SER A 249
ALA A 253
 None
None
None
SO4  A 801 (-3.0A)
None
 1.14A 1h9zA-2i6uA:
undetectable		 1h9zA-2i6uA:
20.61
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.
1XWF_C_ADNC433_2
(ADENOSYLHOMOCYSTEINA
SE)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		3 / 3 THR A 223
GLU A 288
HIS A 128
 None
None
CP  A 500 (-4.3A)
 0.88A 1xwfC-2i6uA:
2.9		 1xwfC-2i6uA:
22.10
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.
1XWF_D_ADND433_2
(ADENOSYLHOMOCYSTEINA
SE)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		3 / 3 THR A 223
GLU A 288
HIS A 128
 None
None
CP  A 500 (-4.3A)
 0.89A 1xwfD-2i6uA:
3.3		 1xwfD-2i6uA:
22.10
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.
2H77_A_T3A1_1
(THRA PROTEIN)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 115
ALA A  43
LEU A  91
LEU A  78
ILE A  45
 None
 1.10A 2h77A-2i6uA:
undetectable		 2h77A-2i6uA:
21.91
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.
2H77_A_T3A1_1
(THRA PROTEIN)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 115
LEU A  91
SER A  92
LEU A  78
ILE A  45
 None
 1.02A 2h77A-2i6uA:
undetectable		 2h77A-2i6uA:
21.91
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.
2H79_A_T3A1_1
(THRA PROTEIN)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 115
LEU A  91
SER A  92
LEU A  78
ILE A  45
 None
 1.04A 2h79A-2i6uA:
undetectable		 2h79A-2i6uA:
21.91
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.
2UVN_A_ECNA1409_1
(CYTOCHROME P450 130)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  20
PRO A  13
THR A 171
THR A 201
GLY A 173
 None
 1.02A 2uvnA-2i6uA:
undetectable		 2uvnA-2i6uA:
24.46
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.
3N2O_C_AG2C1002_1
(BIOSYNTHETIC
ARGININE
DECARBOXYLASE)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		4 / 8 HIS A 163
ASP A 234
LEU A 236
ASP A 156
 None
 1.15A 3n2oC-2i6uA:
undetectable
3n2oD-2i6uA:
undetectable		 3n2oC-2i6uA:
19.87
3n2oD-2i6uA:
19.87
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.
3RAV_A_RAVA183_1
(FERRITIN LIGHT CHAIN)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 6 LEU A 151
SER A 152
TYR A 153
ALA A 214
LEU A 165
 None
 1.40A 3ravA-2i6uA:
undetectable		 3ravA-2i6uA:
21.29
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.
4E1G_A_LNLA701_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		4 / 5 VAL A 176
LEU A 151
SER A 152
MET A 161
 None
 1.31A 4e1gA-2i6uA:
undetectable		 4e1gA-2i6uA:
18.87
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.
4GC9_A_SAMA401_1
(DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		3 / 3 GLU A 272
ASP A 271
ASP A 275
 None
 0.73A 4gc9A-2i6uA:
undetectable		 4gc9A-2i6uA:
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.
4LNW_A_T3A501_1
(THYROID HORMONE
RECEPTOR ALPHA)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 115
ALA A  43
LEU A  91
LEU A  78
ILE A  45
 None
 1.14A 4lnwA-2i6uA:
undetectable		 4lnwA-2i6uA:
21.60
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.
4LNW_A_T3A501_1
(THYROID HORMONE
RECEPTOR ALPHA)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 115
LEU A  91
SER A  92
LEU A  78
ILE A  45
 None
 1.04A 4lnwA-2i6uA:
undetectable		 4lnwA-2i6uA:
21.60
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.
4LNX_A_T3A502_1
(THYROID HORMONE
RECEPTOR ALPHA)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 115
ALA A  43
LEU A  91
LEU A  78
ILE A  45
 None
 1.12A 4lnxA-2i6uA:
undetectable		 4lnxA-2i6uA:
21.60
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.
4LNX_A_T3A502_1
(THYROID HORMONE
RECEPTOR ALPHA)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 115
LEU A  91
SER A  92
LEU A  78
ILE A  45
 None
 1.02A 4lnxA-2i6uA:
undetectable		 4lnxA-2i6uA:
21.60
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.
4Q5M_A_ROCA1101_2
(PROTEASE)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 173
ILE A 139
GLY A 144
GLY A 148
ILE A 174
 None
 0.96A 4q5mA-2i6uA:
undetectable		 4q5mA-2i6uA:
22.41
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.
4QB9_D_PARD500_1
(ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		4 / 8 SER A  73
THR A 102
GLU A 126
ASP A 125
 None
 1.29A 4qb9D-2i6uA:
undetectable		 4qb9D-2i6uA:
24.26
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.
5C6P_A_4YHA601_1
(PROTEIN C)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		4 / 6 ALA A 193
SER A 189
GLN A 105
ASP A   8
 None
 1.22A 5c6pA-2i6uA:
undetectable		 5c6pA-2i6uA:
23.09
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.
5G5G_B_ACTB1321_0
(PUTATIVE XANTHINE
DEHYDROGENASE YAGR
MOLYBDENUM-BINDING
SU SUBUNIT)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		3 / 3 THR A 274
ASP A 275
ALA A 276
 SO4  A 801 (-3.1A)
None
SO4  A 801 ( 3.7A)
 0.11A 5g5gB-2i6uA:
undetectable		 5g5gB-2i6uA:
24.15
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.
5LJD_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 9 LEU A  36
LEU A 303
ILE A  45
ILE A  61
LEU A  91
 None
 1.17A 5ljdA-2i6uA:
0.0		 5ljdA-2i6uA:
17.16
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.
5N0X_B_SAMB501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		3 / 3 SER A 283
ALA A 284
THR A 138
 None
 0.73A 5n0xB-2i6uA:
2.0		 5n0xB-2i6uA:
21.01
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.
5Y7P_G_CHDG401_0
(BILE SALT HYDROLASE)		 2i6u ORNITHINE
CARBAMOYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 10 ILE A 120
LEU A 300
LEU A  22
ALA A  23
GLU A 288
 None
 1.25A 5y7pG-2i6uA:
undetectable		 5y7pG-2i6uA:
23.04