SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4b29'

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.
1A8U_A_BEZA295_0
(CHLOROPEROXIDASE T)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		5 / 10 GLY A 119
PHE A  94
LEU A  50
THR A 179
LEU A 178
 PO4  A1200 (-3.6A)
None
None
EDO  A1201 (-3.5A)
None
 1.24A 1a8uA-4b29A:
undetectable		 1a8uA-4b29A:
19.52
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.
1A8U_B_BEZB294_0
(CHLOROPEROXIDASE T)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		5 / 10 GLY A 119
PHE A  94
LEU A  50
THR A 179
LEU A 178
 PO4  A1200 (-3.6A)
None
None
EDO  A1201 (-3.5A)
None
 1.26A 1a8uB-4b29A:
undetectable		 1a8uB-4b29A:
19.52
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.
2BTE_D_LEUD1893_0
(AMINOACYL-TRNA
SYNTHETASE)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 8 ASP A 191
SER A  80
TYR A  81
TYR A 124
 None
None
None
PO4  A1197 (-4.6A)
 1.31A 2bteD-4b29A:
undetectable		 2bteD-4b29A:
13.73
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.
2KOT_A_ANWA99_0
(PROTEIN S100-A13)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 7 VAL A 115
THR A 114
PHE A  97
ARG A  39
 None
EDO  A1201 (-3.3A)
None
None
 1.13A 2kotA-4b29A:
undetectable		 2kotA-4b29A:
17.14
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.
2V0G_A_LEUA1887_0
(AMINOACYL-TRNA
SYNTHETASE)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 8 ASP A 191
SER A  80
TYR A  81
TYR A 124
 None
None
None
PO4  A1197 (-4.6A)
 1.33A 2v0gA-4b29A:
undetectable		 2v0gA-4b29A:
13.73
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.
2V3K_A_SAMA1254_0
(ESSENTIAL FOR
MITOTIC GROWTH 1)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		5 / 10 LEU A 180
VAL A 115
GLY A 116
LEU A  64
SER A  61
 None
None
EDO  A1201 ( 3.8A)
None
None
 0.98A 2v3kA-4b29A:
undetectable		 2v3kA-4b29A:
18.94
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.
2Y6R_B_CTCB1385_0
(TETX2 PROTEIN)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 8 ARG A  78
PHE A  97
GLY A 116
GLY A 101
 None
None
EDO  A1201 ( 3.8A)
None
 0.87A 2y6rB-4b29A:
undetectable		 2y6rB-4b29A:
24.30
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.
3OU7_C_SAMC300_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		5 / 12 LEU A  91
TYR A  81
TRP A 126
GLY A  87
ALA A 169
 None
 1.22A 3ou7C-4b29A:
undetectable		 3ou7C-4b29A:
22.37
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.
4K0B_B_SAMB504_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 8 HIS A  74
PRO A  73
LYS A   2
ALA A   5
 None
None
PO4  A1199 (-3.3A)
None
 0.91A 4k0bB-4b29A:
undetectable		 4k0bB-4b29A:
19.80
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.
4L7I_B_SAMB501_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 8 HIS A  74
PRO A  73
LYS A   2
ALA A   5
 None
None
PO4  A1199 (-3.3A)
None
 0.95A 4l7iB-4b29A:
undetectable		 4l7iB-4b29A:
19.80
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.
4PAH_A_LNRA600_1
(PHENYLALANINE
HYDROXYLASE)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 6 HIS A 129
HIS A 168
TYR A 135
GLU A 133
 ZN  A1205 ( 3.2A)
ZN  A1205 ( 3.2A)
EDO  A1201 ( 4.1A)
ZN  A1205 ( 2.3A)
 1.02A 4pahA-4b29A:
undetectable		 4pahA-4b29A:
19.75
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.
5L8D_B_ACTB601_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		3 / 3 THR A 174
PRO A 120
ASP A  53
 None
PO4  A1200 (-4.4A)
PO4  A1200 (-3.5A)
 0.91A 5l8dB-4b29A:
undetectable		 5l8dB-4b29A:
19.75
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.
5MWU_B_ACTB601_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		3 / 3 THR A 174
PRO A 120
ASP A  53
 None
PO4  A1200 (-4.4A)
PO4  A1200 (-3.5A)
 0.91A 5mwuB-4b29A:
undetectable		 5mwuB-4b29A:
19.75
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.
5PAH_A_LDPA600_1
(PHENYLALANINE
4-MONOOXYGENASE)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 4 HIS A 129
HIS A 168
TYR A 135
GLU A 133
 ZN  A1205 ( 3.2A)
ZN  A1205 ( 3.2A)
EDO  A1201 ( 4.1A)
ZN  A1205 ( 2.3A)
 1.01A 5pahA-4b29A:
undetectable		 5pahA-4b29A:
19.75
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.
6F3M_A_ADNA502_2
(-)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 4 GLN A 109
THR A 108
THR A 114
LEU A 188
 BR  A1203 (-4.9A)
None
EDO  A1201 (-3.3A)
None
 1.30A 6f3mA-4b29A:
undetectable		 6f3mA-4b29A:
17.36
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.
6F3M_C_ADNC502_2
(-)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 4 GLN A 109
THR A 108
THR A 114
LEU A 188
 BR  A1203 (-4.9A)
None
EDO  A1201 (-3.3A)
None
 1.29A 6f3mC-4b29A:
undetectable		 6f3mC-4b29A:
17.14
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.
6F6S_B_CXQB705_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 6 VAL A 113
LEU A 180
LEU A  64
LEU A  21
 None
 1.06A 6f6sA-4b29A:
undetectable
6f6sB-4b29A:
undetectable		 6f6sA-4b29A:
14.95
6f6sB-4b29A:
18.58
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.
6GBN_B_ADNB501_2
(-)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		4 / 5 GLN A 109
THR A 108
THR A 114
LEU A 188
 BR  A1203 (-4.9A)
None
EDO  A1201 (-3.3A)
None
 1.30A 6gbnB-4b29A:
undetectable		 6gbnB-4b29A:
18.54
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.
6PAH_A_DAHA600_1
(PHENYLALANINE
4-MONOOXYGENASE)		 4b29 DIMETHYLSULFONIOPROP
IONATE LYASE
(Roseovarius
nubinhibens) 		5 / 6 PRO A 192
HIS A 129
HIS A 168
TYR A 135
GLU A 133
 PO4  A1197 (-4.2A)
ZN  A1205 ( 3.2A)
ZN  A1205 ( 3.2A)
EDO  A1201 ( 4.1A)
ZN  A1205 ( 2.3A)
 1.02A 6pahA-4b29A:
undetectable		 6pahA-4b29A:
19.75