SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3bwx'

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.
1A4L_B_DCFB853_2
(ADENOSINE DEAMINASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 5 HIS A 264
LEU A 268
LEU A 224
GLY A 102
 None
 0.96A 1a4lB-3bwxA:
2.4		 1a4lB-3bwxA:
22.85
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.
1H4O_G_BEZG1162_0
(PEROXIREDOXIN 5)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 8 PRO A 228
PRO A 252
GLY A 253
ARG A 283
 None
 0.85A 1h4oG-3bwxA:
undetectable		 1h4oG-3bwxA:
20.07
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.
1XDK_B_9CRB600_1
(RETINOIC ACID
RECEPTOR, BETA)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 12 ALA A 116
ILE A 121
PHE A  98
LEU A  32
LEU A  83
 None
 1.13A 1xdkB-3bwxA:
undetectable		 1xdkB-3bwxA:
22.51
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.
2OPX_A_DXCA1002_0
(ALDEHYDE
DEHYDROGENASE A)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		3 / 3 GLY A  64
ARG A  65
TYR A  70
 None
EDO  A 300 (-4.0A)
None
 0.81A 2opxA-3bwxA:
3.2		 2opxA-3bwxA:
20.62
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.
2V0Z_O_C41O1327_2
(RENIN)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 8 SER A 134
SER A 104
PRO A 266
THR A 212
 None
 1.15A 2v0zO-3bwxA:
undetectable		 2v0zO-3bwxA:
21.64
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.
3COT_A_STRA1501_1
(3-OXO-5-BETA-STEROID
4-DEHYDROGENASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 7 TYR A 144
TYR A 180
TRP A 172
TRP A 177
 None
None
EDO  A 291 ( 3.9A)
None
 1.25A 3cotA-3bwxA:
1.8		 3cotA-3bwxA:
21.86
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.
3H5G_B_LEIB16_0
(COIL SER L16D-PEN)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 5 LEU A 113
GLN A  84
LEU A  86
GLU A  87
 None
 0.86A 3h5gA-3bwxA:
undetectable
3h5gB-3bwxA:
undetectable		 3h5gA-3bwxA:
7.50
3h5gB-3bwxA:
7.50
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.
3HCO_A_CHDA3_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 4 LEU A  58
PRO A  60
LEU A  32
ARG A 120
 None
None
None
EDO  A 296 (-3.9A)
 1.14A 3hcoA-3bwxA:
2.8		 3hcoA-3bwxA:
20.81
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.
3N8X_B_NIMB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 12 LEU A 113
PHE A  98
ILE A 121
ALA A 124
LEU A 126
 None
 1.12A 3n8xB-3bwxA:
undetectable		 3n8xB-3bwxA:
19.28
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.
3TNE_B_RITB401_2
(SECRETED ASPARTIC
PROTEASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 7 VAL A 125
ILE A 277
THR A 267
TYR A 169
 None
None
EDO  A 289 (-2.9A)
None
 0.95A 3tneB-3bwxA:
undetectable		 3tneB-3bwxA:
21.94
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.
3WDM_A_ADNA901_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 9 ALA A 276
ARG A 279
GLY A 278
LEU A 281
ILE A 101
 None
 0.99A 3wdmA-3bwxA:
undetectable		 3wdmA-3bwxA:
25.00
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.
3WDM_B_ADNB301_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 10 ALA A 276
ARG A 279
GLY A 278
LEU A  47
ILE A 101
 None
 1.08A 3wdmB-3bwxA:
1.6		 3wdmB-3bwxA:
25.00
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.
3WDM_B_ADNB301_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 10 ALA A 276
ARG A 279
GLY A 278
LEU A 281
ILE A 101
 None
 0.96A 3wdmB-3bwxA:
1.6		 3wdmB-3bwxA:
25.00
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.
3WDM_D_ADND301_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 10 ALA A 276
ARG A 279
GLY A 278
LEU A  47
ILE A 101
 None
 1.09A 3wdmD-3bwxA:
undetectable		 3wdmD-3bwxA:
25.00
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.
3WDM_D_ADND301_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 10 ALA A 276
ARG A 279
GLY A 278
LEU A 281
ILE A 101
 None
 0.92A 3wdmD-3bwxA:
undetectable		 3wdmD-3bwxA:
25.00
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.
3WXO_A_NIZA804_1
(CATALASE-PEROXIDASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		3 / 3 ASN A  40
GLU A  61
ARG A  20
 EDO  A 301 (-3.8A)
EDO  A 301 (-2.8A)
EDO  A 301 ( 4.6A)
 0.84A 3wxoA-3bwxA:
undetectable		 3wxoA-3bwxA:
17.51
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.
4ACA_C_DXCC1477_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 6 THR A 212
GLY A 210
ILE A 141
LEU A 105
 None
CL  A 287 (-4.0A)
None
EDO  A 300 (-3.2A)
 1.13A 4acaC-3bwxA:
4.2		 4acaC-3bwxA:
20.66
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.
4EOH_A_TEPA402_1
(PYRIDOXAL KINASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		4 / 5 SER A 237
GLY A 234
THR A 244
VAL A 231
 None
 1.10A 4eohA-3bwxA:
5.9		 4eohA-3bwxA:
25.44
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.
4K13_A_ETSA304_1
(CARBONIC ANHYDRASE 2)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 12 VAL A  31
LEU A 281
LEU A  51
VAL A  57
LEU A  47
 None
 1.01A 4k13A-3bwxA:
undetectable		 4k13A-3bwxA:
23.68
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.
4PST_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		3 / 3 ILE A 141
ASP A 238
ARG A  39
 None
 0.71A 4pstA-3bwxA:
undetectable		 4pstA-3bwxA:
19.10
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.
4ZE0_A_VORA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 9 PHE A  44
ILE A 101
GLY A 106
LEU A  86
LEU A  90
 None
None
EDO  A 300 (-4.3A)
None
EDO  A 296 ( 3.9A)
 1.38A 4ze0A-3bwxA:
undetectable		 4ze0A-3bwxA:
19.56
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.
5E72_A_SAMA400_0
(N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 12 PHE A 195
GLY A  64
ILE A 201
ILE A 193
LEU A 161
 None
 0.98A 5e72A-3bwxA:
2.6		 5e72A-3bwxA:
22.66
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.
5NFJ_A_SAMA501_0
(MITOCHONDRIAL
RIBONUCLEASE P
PROTEIN 1)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 12 LEU A  90
ALA A  88
ILE A  95
GLY A  94
LEU A  86
 EDO  A 296 ( 3.9A)
None
None
None
None
 1.01A 5nfjA-3bwxA:
undetectable		 5nfjA-3bwxA:
19.23
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.
6DRX_A_H8GA1201_0
(5HT2B RECEPTOR, BRIL
CHIMERA)		 3bwx ALPHA/BETA HYDROLASE
(Novosphingobium
aromaticivorans) 		5 / 12 SER A 165
PHE A 195
ALA A 160
TRP A 177
TYR A 169
 None
None
EDO  A 298 (-3.9A)
None
None
 1.29A 6drxA-3bwxA:
undetectable		 6drxA-3bwxA:
22.12