SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '30Q'


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.
3V3O_D_T1CD401_1
(TETX2 PROTEIN)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		5 / 10 ASP B 305
HIS B 181
PHE B 297
GLY B 295
MET B 224
 FE2  B 401 ( 2.1A)
FE2  B 401 (-3.4A)
30Q  B 403 ( 4.7A)
None
None
 1.12A 3v3oD-4qdfB:
undetectable		 3v3oD-4qdfB:
22.53
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.
4KUK_A_RBFA201_1
(BLUE-LIGHT
PHOTORECEPTOR)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		5 / 12 ASN B 258
GLN B 204
ASN B 195
LEU B 330
ILE B 173
 30Q  B 403 ( 4.7A)
30Q  B 403 (-4.0A)
None
None
None
 1.24A 4kukA-4qdfB:
undetectable		 4kukA-4qdfB:
15.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)		 4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		8 / 12 ASN A 181
VAL A 182
GLN A 210
LEU A 233
ALA A 237
MET A 245
LEU A 262
ASN A 264
 FE2  A 402 (-4.2A)
30Q  A 403 (-3.5A)
30Q  A 403 (-3.6A)
None
30Q  A 403 ( 3.7A)
30Q  A 403 ( 3.8A)
None
None
 0.57A 4qckA-4qddA:
44.1		 4qckA-4qddA:
61.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)		 4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		8 / 12 ASN A 181
VAL A 182
HIS A 192
GLN A 210
ALA A 237
MET A 245
LEU A 262
ASN A 264
 FE2  A 402 (-4.2A)
30Q  A 403 (-3.5A)
FE2  A 402 ( 3.5A)
30Q  A 403 (-3.6A)
30Q  A 403 ( 3.7A)
30Q  A 403 ( 3.8A)
None
None
 0.63A 4qckA-4qddA:
44.1		 4qckA-4qddA:
61.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)		 4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		7 / 12 ASN A 181
VAL A 182
HIS A 192
GLN A 210
MET A 245
ASN A 264
GLY A 307
 FE2  A 402 (-4.2A)
30Q  A 403 (-3.5A)
FE2  A 402 ( 3.5A)
30Q  A 403 (-3.6A)
30Q  A 403 ( 3.8A)
None
None
 1.00A 4qckA-4qddA:
44.1		 4qckA-4qddA:
61.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)		 4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		5 / 12 ASN A 181
VAL A 182
HIS A 192
GLY A 307
ASP A 311
 FE2  A 402 (-4.2A)
30Q  A 403 (-3.5A)
FE2  A 402 ( 3.5A)
None
FE2  A 402 (-2.3A)
 0.99A 4qckA-4qddA:
44.1		 4qckA-4qddA:
61.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)		 4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		5 / 12 HIS A 187
GLN A 210
ALA A 237
MET A 245
ASN A 264
 FE2  A 402 (-3.5A)
30Q  A 403 (-3.6A)
30Q  A 403 ( 3.7A)
30Q  A 403 ( 3.8A)
None
 1.13A 4qckA-4qddA:
44.1		 4qckA-4qddA:
61.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		9 / 12 ASN B 175
HIS B 186
GLN B 204
ALA B 231
MET B 239
LEU B 256
ASN B 258
GLY B 301
ASP B 305
 FE2  B 401 (-4.9A)
FE2  B 401 ( 3.5A)
30Q  B 403 (-4.0A)
30Q  B 403 ( 3.7A)
30Q  B 403 (-3.6A)
None
30Q  B 403 ( 4.7A)
30Q  B 403 ( 4.3A)
FE2  B 401 ( 2.1A)
 0.33A 4qckA-4qdfB:
48.2		 4qckA-4qdfB:
58.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		6 / 12 ASN B 175
HIS B 186
GLN B 204
LEU B 243
GLY B 301
ASP B 305
 FE2  B 401 (-4.9A)
FE2  B 401 ( 3.5A)
30Q  B 403 (-4.0A)
30Q  B 403 (-4.8A)
30Q  B 403 ( 4.3A)
FE2  B 401 ( 2.1A)
 1.26A 4qckA-4qdfB:
48.2		 4qckA-4qdfB:
58.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QDC_A_ASDA404_1
(3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE)		 4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		5 / 12 HIS A 187
MET A 212
SER A 235
ALA A 237
MET A 245
 FE2  A 402 (-3.5A)
None
30Q  A 403 (-3.6A)
30Q  A 403 ( 3.7A)
30Q  A 403 ( 3.8A)
 1.02A 4qdcA-4qddA:
50.5		 4qdcA-4qddA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QDC_A_ASDA404_1
(3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE)		 4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		12 / 12 VAL A 182
HIS A 192
GLN A 210
MET A 212
LEU A 233
SER A 235
ALA A 237
MET A 245
ASP A 247
LEU A 262
ASN A 264
PHE A 300
 30Q  A 403 (-3.5A)
FE2  A 402 ( 3.5A)
30Q  A 403 (-3.6A)
None
None
30Q  A 403 (-3.6A)
30Q  A 403 ( 3.7A)
30Q  A 403 ( 3.8A)
30Q  A 403 (-3.7A)
None
None
30Q  A 403 (-3.6A)
 0.54A 4qdcA-4qddA:
50.5		 4qdcA-4qddA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QDC_A_ASDA404_1
(3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		5 / 12 HIS B 181
MET B 206
SER B 229
ALA B 231
MET B 239
 FE2  B 401 (-3.4A)
30Q  B 403 ( 4.6A)
30Q  B 403 (-3.4A)
30Q  B 403 ( 3.7A)
30Q  B 403 (-3.6A)
 1.32A 4qdcA-4qdfB:
45.0		 4qdcA-4qdfB:
62.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QDC_A_ASDA404_1
(3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		5 / 12 HIS B 186
GLN B 204
ALA B 231
ASP B 241
LEU B 243
 FE2  B 401 ( 3.5A)
30Q  B 403 (-4.0A)
30Q  B 403 ( 3.7A)
30Q  B 403 (-3.5A)
30Q  B 403 (-4.8A)
 1.38A 4qdcA-4qdfB:
45.0		 4qdcA-4qdfB:
62.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QDC_A_ASDA404_1
(3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		9 / 12 HIS B 186
GLN B 204
MET B 206
SER B 229
ALA B 231
MET B 239
ASP B 241
LEU B 256
ASN B 258
 FE2  B 401 ( 3.5A)
30Q  B 403 (-4.0A)
30Q  B 403 ( 4.6A)
30Q  B 403 (-3.4A)
30Q  B 403 ( 3.7A)
30Q  B 403 (-3.6A)
30Q  B 403 (-3.5A)
None
30Q  B 403 ( 4.7A)
 0.85A 4qdcA-4qdfB:
45.0		 4qdcA-4qdfB:
62.75
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.
4XP6_A_B40A601_1
(TRANSPORTER)		 4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		4 / 5 ASP A 247
VAL A 304
PHE A 300
GLY A 279
 30Q  A 403 (-3.7A)
30Q  A 403 ( 3.9A)
30Q  A 403 (-3.6A)
None
 1.21A 4xp6A-4qddA:
undetectable		 4xp6A-4qddA:
20.60
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.
6N91_A_DCFA401_1
(ADENOSINE DEAMINASE)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		4 / 4 HIS B 181
LEU B 243
TYR B 245
GLY B 301
 FE2  B 401 (-3.4A)
30Q  B 403 (-4.8A)
30Q  B 403 (-4.3A)
30Q  B 403 ( 4.3A)
 1.24A 6n91A-4qdfB:
undetectable		 6n91A-4qdfB:
11.66
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.
6N91_B_DCFB401_1
(ADENOSINE DEAMINASE)		 4qdf 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE
(Rhodococcus
rhodochrous) 		4 / 4 HIS B 181
LEU B 243
TYR B 245
GLY B 301
 FE2  B 401 (-3.4A)
30Q  B 403 (-4.8A)
30Q  B 403 (-4.3A)
30Q  B 403 ( 4.3A)
 1.23A 6n91B-4qdfB:
undetectable		 6n91B-4qdfB:
11.66