SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4rpa'

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.
1E7A_B_PFLB4002_1
(SERUM ALBUMIN)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 6 PHE A 207
LEU A 249
VAL A 274
VAL A 300
 None
 0.84A 1e7aB-4rpaA:
undetectable		 1e7aB-4rpaA:
20.21
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.
1HXB_A_ROCA100_4
(HIV-1 PROTEASE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 4 GLY A 275
ASP A 272
GLY A 268
THR A 214
 None
 1.00A 1hxbB-4rpaA:
undetectable		 1hxbB-4rpaA:
13.92
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.
2G72_B_SAMB2002_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		5 / 12 LEU A 109
ILE A  95
VAL A  74
HIS A  76
ALA A  35
 OCS  A 110 ( 3.6A)
None
None
None
None
 1.12A 2g72B-4rpaA:
undetectable		 2g72B-4rpaA:
23.39
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.
2J2P_B_SC2B1290_1
(FICOLIN-2)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 8 LEU A 151
SER A 148
LEU A 185
ASP A  13
 None
None
None
MN  A 501 (-2.0A)
 1.01A 2j2pA-4rpaA:
undetectable
2j2pB-4rpaA:
undetectable		 2j2pA-4rpaA:
22.08
2j2pB-4rpaA:
22.08
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.
2J2P_F_SC2F1291_1
(FICOLIN-2)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 6 LEU A 151
SER A 148
ASP A  13
ASP A  15
 None
None
MN  A 501 (-2.0A)
MN  A 500 (-2.9A)
 0.97A 2j2pE-4rpaA:
undetectable
2j2pF-4rpaA:
undetectable		 2j2pE-4rpaA:
22.08
2j2pF-4rpaA:
22.08
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_A_SHHA301_1
(HISTONE DEACETYLASE
7A)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 5 HIS A  97
HIS A  98
ASP A 149
ASP A  13
 MN  A 500 (-3.2A)
MN  A 500 (-4.7A)
MN  A 500 (-2.6A)
MN  A 501 (-2.0A)
 0.99A 3c0zA-4rpaA:
undetectable		 3c0zA-4rpaA:
21.14
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.
3C0Z_C_SHHC301_1
(HISTONE DEACETYLASE
7A)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 6 HIS A  97
HIS A  98
ASP A 149
ASP A  13
 MN  A 500 (-3.2A)
MN  A 500 (-4.7A)
MN  A 500 (-2.6A)
MN  A 501 (-2.0A)
 1.01A 3c0zC-4rpaA:
undetectable		 3c0zC-4rpaA:
21.14
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.
3HAV_A_SRYA403_1
(AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 8 ASP A 256
SER A 260
ASP A 223
ASP A 183
 None
 1.26A 3havA-4rpaA:
undetectable		 3havA-4rpaA:
23.16
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.
3K4V_D_ROCD201_2
(HIV-1 PROTEASE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 4 GLY A 275
ASP A 272
GLY A 268
THR A 214
 None
 0.96A 3k4vC-4rpaA:
undetectable		 3k4vC-4rpaA:
14.24
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.
3OND_A_ADNA506_2
(ADENOSYLHOMOCYSTEINA
SE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		3 / 3 GLN A  48
THR A  47
LEU A  61
 None
 0.51A 3ondA-4rpaA:
2.6		 3ondA-4rpaA:
23.65
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.
3OND_B_ADNB507_2
(ADENOSYLHOMOCYSTEINA
SE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		3 / 3 GLN A  48
THR A  47
LEU A  61
 None
 0.51A 3ondB-4rpaA:
undetectable		 3ondB-4rpaA:
23.65
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.
4JSE_A_H4BA804_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 7 MET A  23
ARG A 112
VAL A  74
GLU A  27
 None
 1.47A 4jseA-4rpaA:
undetectable
4jseB-4rpaA:
undetectable		 4jseA-4rpaA:
20.87
4jseB-4rpaA:
20.87
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.
4LUH_A_ACTA610_0
(SERUM ALBUMIN)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		3 / 3 VAL A  43
SER A  44
THR A  47
 None
 0.47A 4luhA-4rpaA:
undetectable		 4luhA-4rpaA:
19.83
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.
4NKX_B_STRB601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 5 ILE A 147
LEU A 152
ASP A 183
GLU A  46
 None
 0.95A 4nkxB-4rpaA:
undetectable		 4nkxB-4rpaA:
21.98
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.
4O1Z_A_MXMA807_2
(PROSTAGLANDIN G/H
SYNTHASE 1)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 6 VAL A 227
LEU A 228
ARG A 230
LEU A 252
 None
 0.93A 4o1zA-4rpaA:
undetectable		 4o1zA-4rpaA:
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.
4P66_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		5 / 11 ILE A  22
ASP A  15
LEU A  51
ILE A  21
THR A 119
 None
MN  A 500 (-2.9A)
None
None
None
 1.14A 4p66A-4rpaA:
undetectable		 4p66A-4rpaA:
17.20
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_3
(PROTEASE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		3 / 3 ASP A 149
ASP A  75
ASN A  77
 MN  A 500 (-2.6A)
MN  A 500 ( 2.4A)
None
 0.82A 4q5mA-4rpaA:
undetectable		 4q5mA-4rpaA:
18.81
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.
5CVT_B_ACTB200_0
(N5-CARBOXYAMINOIMIDA
ZOLE RIBONUCLEOTIDE
MUTASE)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		3 / 3 ASN A  11
ALA A 204
ARG A 215
 None
 0.77A 5cvtB-4rpaA:
undetectable		 5cvtB-4rpaA:
21.84
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.
5IGT_A_ERYA402_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		5 / 12 ILE A 257
VAL A 219
VAL A 227
LEU A 289
GLY A 291
 None
 1.03A 5igtA-4rpaA:
1.7		 5igtA-4rpaA:
23.19
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.
5MVM_A_PFLA511_1
(PROTON-GATED ION
CHANNEL)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 8 ALA A  58
ILE A  17
ALA A  20
ILE A  21
 None
 0.64A 5mvmA-4rpaA:
undetectable
5mvmB-4rpaA:
undetectable		 5mvmA-4rpaA:
17.67
5mvmB-4rpaA:
17.67
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.
6J20_A_GBQA1201_1
(SUBSTANCE-P
RECEPTOR,ENDOLYSIN)		 4rpa PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Staphylococcus
aureus) 		4 / 7 ILE A  91
GLU A  78
HIS A  76
VAL A  94
 None
None
None
OCS  A 110 ( 4.6A)
 1.09A 6j20A-4rpaA:
undetectable		 6j20A-4rpaA:
19.82