SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '6aqj'

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.
1E06_B_IPBB600_0
(ODORANT-BINDING
PROTEIN)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		4 / 4 ILE A  45
MET A  77
VAL A 136
GLY A  24
 None
None
None
NDP  A 407 ( 3.7A)
 1.00A 1e06B-6aqjA:
undetectable		 1e06B-6aqjA:
18.71
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.
1PXX_A_DIFA701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		5 / 10 LEU A  36
TYR A  41
ALA A 168
SER A 166
LEU A 165
 None
 1.13A 1pxxA-6aqjA:
undetectable		 1pxxA-6aqjA:
18.73
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.
2PIV_A_T3A933_1
(ANDROGEN RECEPTOR)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		5 / 9 PRO A  81
ILE A  84
GLY A 297
GLU A 300
TYR A 302
 NDP  A 407 (-3.7A)
NDP  A 407 (-4.3A)
None
None
None
 1.43A 2pivA-6aqjA:
undetectable		 2pivA-6aqjA:
20.90
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.
3IA4_A_MTXA164_2
(DIHYDROFOLATE
REDUCTASE)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		4 / 4 ILE A 111
PHE A 105
ILE A 116
THR A 187
 None
 1.17A 3ia4A-6aqjA:
undetectable		 3ia4A-6aqjA:
19.45
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.
3KM6_B_EAAB222_1
(GLUTATHIONE
S-TRANSFERASE P)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		5 / 9 VAL A  70
VAL A  78
GLN A  85
VAL A 122
ASN A 101
 None
None
NDP  A 407 (-3.9A)
None
None
 1.48A 3km6B-6aqjA:
undetectable		 3km6B-6aqjA:
20.69
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.
3R24_A_SAMA302_1
(2'-O-METHYL
TRANSFERASE)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		3 / 3 TYR A  25
ASP A  38
ASP A  59
 GOL  A 405 ( 4.9A)
None
None
 0.72A 3r24A-6aqjA:
undetectable		 3r24A-6aqjA:
23.12
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.
4LB0_B_ACTB401_0
(UNCHARACTERIZED
PROTEIN)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		4 / 5 VAL A  78
LEU A 103
VAL A 124
PHE A 105
 None
 0.95A 4lb0B-6aqjA:
undetectable		 4lb0B-6aqjA:
21.81
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.
4S0V_A_SUVA2001_2
(HUMAN OREXIN
RECEPTOR TYPE 2
FUSION PROTEIN TO P.
ABYSII GLYCOGEN
SYNTHASE)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		4 / 5 ILE A  84
PRO A  81
HIS A 134
VAL A  22
 NDP  A 407 (-4.3A)
NDP  A 407 (-3.7A)
GOL  A 405 (-4.1A)
None
 1.03A 4s0vA-6aqjA:
2.8		 4s0vA-6aqjA:
20.78
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.
5IKQ_B_JMSB602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		5 / 12 LEU A  36
TYR A  41
ALA A 168
SER A 166
LEU A 165
 None
 1.14A 5ikqB-6aqjA:
undetectable		 5ikqB-6aqjA:
20.32
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.
6BXN_B_SAMB901_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)		 6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))
(Staphylococcus
aureus) 		5 / 12 PHE A 140
LEU A 135
GLY A 133
HIS A 134
ILE A 171
 None
GOL  A 404 ( 4.4A)
NDP  A 407 (-3.9A)
GOL  A 405 (-4.1A)
None
 1.38A 6bxnB-6aqjA:
2.5		 6bxnB-6aqjA:
21.50