SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3r2u'

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.
1E9Y_B_HAEB800_1
(UREASE SUBUNIT BETA)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 5 HIS A 119
HIS A 195
HIS A  56
ASP A 156
 FE  A 443 (-3.4A)
None
FE  A 443 (-3.6A)
FE  A 443 ( 4.4A)
 0.92A 1e9yB-3r2uA:
undetectable		 1e9yB-3r2uA:
21.06
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.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		6 / 12 PRO A  31
SER A  63
GLY A 144
ASP A 145
PHE A 148
VAL A 149
 None
None
None
FE  A 443 (-3.2A)
None
None
 1.24A 1ffyA-3r2uA:
undetectable		 1ffyA-3r2uA:
18.57
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.
1GSF_C_EAAC223_1
(GLUTATHIONE
TRANSFERASE A1-1)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 8 PHE A   3
GLY A  19
LEU A  47
VAL A  41
 None
 0.99A 1gsfC-3r2uA:
undetectable		 1gsfC-3r2uA:
18.98
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.
1HSH_A_MK1A401_1
(HIV-II PROTEASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		6 / 12 ASP A  67
ASP A  34
ILE A  32
GLY A 335
ILE A 252
ILE A  65
 None
 1.47A 1hshA-3r2uA:
undetectable		 1hshA-3r2uA:
11.40
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.
1ICU_A_NIOA221_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 6 SER A 123
THR A 120
PHE A 148
GLY A 144
 None
 1.12A 1icuA-3r2uA:
undetectable
1icuB-3r2uA:
undetectable		 1icuA-3r2uA:
19.74
1icuB-3r2uA:
19.74
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.
1ICU_D_NIOD223_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 5 PHE A 148
GLY A 144
SER A 123
THR A 120
 None
 1.15A 1icuC-3r2uA:
undetectable
1icuD-3r2uA:
undetectable		 1icuC-3r2uA:
19.74
1icuD-3r2uA:
19.74
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.
1ICV_B_NIOB702_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 5 PHE A 148
GLY A 144
SER A 123
THR A 120
 None
 1.18A 1icvA-3r2uA:
undetectable
1icvB-3r2uA:
undetectable		 1icvA-3r2uA:
19.74
1icvB-3r2uA:
19.74
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.
1KQB_A_BEZA524_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 6 SER A 123
THR A 120
PHE A 148
GLY A 144
 None
 1.12A 1kqbA-3r2uA:
undetectable
1kqbB-3r2uA:
undetectable		 1kqbA-3r2uA:
19.13
1kqbB-3r2uA:
19.13
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.
1KQB_C_BEZC522_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 6 SER A 123
THR A 120
PHE A 148
GLY A 144
 None
 1.16A 1kqbC-3r2uA:
undetectable
1kqbD-3r2uA:
undetectable		 1kqbC-3r2uA:
19.13
1kqbD-3r2uA:
19.13
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.
1KQB_D_BEZD523_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 6 PHE A 148
GLY A 144
SER A 123
THR A 120
 None
 1.11A 1kqbC-3r2uA:
undetectable
1kqbD-3r2uA:
undetectable		 1kqbC-3r2uA:
19.13
1kqbD-3r2uA:
19.13
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.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		6 / 12 PRO A  31
SER A  63
GLY A 144
ASP A 145
PHE A 148
VAL A 149
 None
None
None
FE  A 443 (-3.2A)
None
None
 1.24A 1qu2A-3r2uA:
undetectable		 1qu2A-3r2uA:
18.57
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.
1ZZ1_B_SHHB2552_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		6 / 12 ILE A  32
HIS A  56
HIS A  58
ASP A 145
HIS A 195
GLY A 144
 None
FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
 1.46A 1zz1B-3r2uA:
undetectable
1zz1C-3r2uA:
undetectable		 1zz1B-3r2uA:
21.78
1zz1C-3r2uA:
21.78
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.
2A68_C_RBTC8001_1
(DNA-DIRECTED RNA
POLYMERASE BETA
CHAIN
RNA POLYMERASE SIGMA
FACTOR RPOD)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 11 ASP A 151
ARG A 154
SER A 237
PRO A 155
ILE A 236
 None
 1.45A 2a68C-3r2uA:
0.0
2a68F-3r2uA:
0.0		 2a68C-3r2uA:
16.70
2a68F-3r2uA:
20.72
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.
2Q0I_A_BEZA990_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 8 ASP A  60
ASP A 145
HIS A 195
SER A 199
 FE  A 443 ( 4.2A)
FE  A 443 (-3.2A)
None
None
 1.04A 2q0iA-3r2uA:
14.4		 2q0iA-3r2uA:
18.83
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.
2Q0J_A_BEZA500_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 10 ASP A  60
HIS A 119
ASP A 145
HIS A 195
SER A 199
 FE  A 443 ( 4.2A)
FE  A 443 (-3.4A)
FE  A 443 (-3.2A)
None
None
 0.97A 2q0jA-3r2uA:
14.2		 2q0jA-3r2uA:
22.46
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.
2Q0J_B_BEZB500_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 11 ASP A  60
HIS A 119
ASP A 145
HIS A 195
SER A 199
 FE  A 443 ( 4.2A)
FE  A 443 (-3.4A)
FE  A 443 (-3.2A)
None
None
 0.99A 2q0jB-3r2uA:
14.6		 2q0jB-3r2uA:
22.46
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.
2V0M_D_KLND1499_1
(CYTOCHROME P450 3A4)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 5 PHE A 142
PHE A   6
PHE A   3
ILE A  39
 None
 1.39A 2v0mD-3r2uA:
undetectable		 2v0mD-3r2uA:
22.18
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.
2XH9_A_J01A1436_1
(ORF12)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 8 LEU A 235
GLY A 171
ALA A 172
LYS A 173
 None
 0.92A 2xh9A-3r2uA:
undetectable		 2xh9A-3r2uA:
20.46
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.
3C0Z_B_SHHB301_1
(HISTONE DEACETYLASE
7A)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 8 HIS A  56
HIS A  58
ASP A 145
HIS A 195
GLY A 144
 FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
 1.38A 3c0zB-3r2uA:
undetectable		 3c0zB-3r2uA:
20.95
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.
3S45_B_478B201_1
(PROTEASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		6 / 9 ASP A  67
ASP A  34
ILE A  32
GLY A 335
ILE A 252
ILE A  65
 None
 1.43A 3s45A-3r2uA:
undetectable		 3s45A-3r2uA:
11.40
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.
3SFU_A_RBVA601_1
(RNA POLYMERASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 9 SER A 224
THR A 219
ASN A 220
GLY A 150
ASP A 151
 None
 1.45A 3sfuA-3r2uA:
undetectable		 3sfuA-3r2uA:
21.56
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.
4BZ6_A_SHHA700_1
(HISTONE DEACETYLASE
8)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 10 HIS A  56
HIS A  58
ASP A 145
HIS A 195
GLY A 144
 FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
 1.39A 4bz6A-3r2uA:
undetectable		 4bz6A-3r2uA:
21.21
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.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 12 ASP A   8
HIS A  56
HIS A  58
ASP A 145
GLY A 194
 None
FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
 1.39A 4bz6A-3r2uA:
undetectable
4bz6B-3r2uA:
undetectable		 4bz6A-3r2uA:
21.21
4bz6B-3r2uA:
21.21
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.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 12 HIS A  56
HIS A  58
ASP A 145
HIS A 195
GLY A 144
 FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
 1.39A 4bz6A-3r2uA:
undetectable
4bz6B-3r2uA:
undetectable		 4bz6A-3r2uA:
21.21
4bz6B-3r2uA:
21.21
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.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 12 HIS A  56
HIS A  58
ASP A 145
PHE A  61
GLY A 144
 FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
 1.18A 4bz6A-3r2uA:
undetectable
4bz6B-3r2uA:
undetectable		 4bz6A-3r2uA:
21.21
4bz6B-3r2uA:
21.21
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.
4BZ6_C_SHHC700_1
(HISTONE DEACETYLASE
8)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		6 / 12 HIS A  56
HIS A  58
ASP A 145
HIS A 195
PHE A  61
GLY A 144
 FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
None
 1.36A 4bz6C-3r2uA:
undetectable		 4bz6C-3r2uA:
21.21
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.
4BZ6_D_SHHD700_1
(HISTONE DEACETYLASE
8)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 10 HIS A  56
HIS A  58
ASP A 145
HIS A 195
GLY A 144
 FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
 1.41A 4bz6D-3r2uA:
undetectable		 4bz6D-3r2uA:
21.21
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.
4H9M_A_HAEA929_1
(UREASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 5 HIS A 119
HIS A 195
HIS A  56
ASP A 156
 FE  A 443 (-3.4A)
None
FE  A 443 (-3.6A)
FE  A 443 ( 4.4A)
 0.89A 4h9mA-3r2uA:
undetectable		 4h9mA-3r2uA:
19.91
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.
4LXZ_B_SHHB408_1
(HISTONE DEACETYLASE
2)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 11 HIS A  56
HIS A  58
ASP A 145
HIS A 195
GLY A 144
 FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
 1.40A 4lxzB-3r2uA:
undetectable		 4lxzB-3r2uA:
20.53
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.
4R3A_B_RBFB402_1
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 10 ILE A 147
GLN A 239
LEU A 235
MET A 175
PHE A 146
 None
 1.44A 4r3aB-3r2uA:
undetectable		 4r3aB-3r2uA:
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.
5DLV_A_5D5A930_1
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 6 SER A  37
TYR A  38
LYS A   4
PHE A   6
 None
 1.42A 5dlvA-3r2uA:
0.1		 5dlvA-3r2uA:
18.99
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.
5DLV_B_5D5B927_1
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 7 SER A  37
TYR A  38
LYS A   4
PHE A   6
 None
 1.40A 5dlvB-3r2uA:
undetectable		 5dlvB-3r2uA:
18.99
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.
5EEN_A_5OGA804_1
(HDAC6 PROTEIN)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 12 HIS A  56
HIS A  58
ASP A 145
PHE A  61
GLY A 144
 FE  A 443 (-3.6A)
None
FE  A 443 (-3.2A)
None
None
 1.13A 5eenA-3r2uA:
undetectable		 5eenA-3r2uA:
22.18
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.
5EWU_B_BEZB1401_0
(MAGNESIUM-CHELATASE
SUBUNIT CHLH,
CHLOROPLASTIC)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		4 / 6 GLY A 118
THR A 120
SER A 178
HIS A 115
 None
 1.05A 5ewuB-3r2uA:
undetectable		 5ewuB-3r2uA:
22.58
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.
5HW8_B_FK5B201_1
(FK506-BINDING
PROTEIN 1)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		5 / 11 ASP A  30
PHE A 126
VAL A  98
TYR A  88
ILE A  57
 None
 1.26A 5hw8B-3r2uA:
undetectable		 5hw8B-3r2uA:
15.14
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.
5OEX_A_CUA604_0
(THIOCYANATE
DEHYDROGENASE)		 3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN
(Staphylococcus
aureus) 		3 / 3 HIS A 119
HIS A  56
HIS A  58
 FE  A 443 (-3.4A)
FE  A 443 (-3.6A)
None
 0.98A 5oexA-3r2uA:
undetectable		 5oexA-3r2uA:
23.33