SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2cfc'

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.
1FM6_X_BRLX504_1
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 12 ILE A 118
PHE A 119
GLY A 121
CYH A 122
TYR A 173
 None
 0.75A 1fm6X-2cfcA:
undetectable		 1fm6X-2cfcA:
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.
1N2X_B_SAMB402_1
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		4 / 5 ASP A  82
VAL A   4
SER A   2
GLN A 132
 None
 1.50A 1n2xB-2cfcA:
9.9		 1n2xB-2cfcA:
19.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UAY_A_ADNA1001_1
(TYPE II
3-HYDROXYACYL-COA
DEHYDROGENASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		8 / 11 GLY A   9
SER A  12
ASP A  33
LEU A  34
ASP A  60
VAL A  61
ALA A  88
VAL A 113
 NAD  A1251 (-3.5A)
NAD  A1251 (-2.7A)
NAD  A1251 (-2.7A)
NAD  A1251 (-4.2A)
NAD  A1251 (-3.4A)
NAD  A1251 (-3.5A)
NAD  A1251 (-3.6A)
NAD  A1251 ( 4.1A)
 0.32A 1uayA-2cfcA:
30.6		 1uayA-2cfcA:
36.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UAY_B_ADNB1002_1
(TYPE II
3-HYDROXYACYL-COA
DEHYDROGENASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		8 / 10 GLY A   9
SER A  12
ASP A  33
LEU A  34
ASP A  60
VAL A  61
ALA A  88
VAL A 113
 NAD  A1251 (-3.5A)
NAD  A1251 (-2.7A)
NAD  A1251 (-2.7A)
NAD  A1251 (-4.2A)
NAD  A1251 (-3.4A)
NAD  A1251 (-3.5A)
NAD  A1251 (-3.6A)
NAD  A1251 ( 4.1A)
 0.34A 1uayB-2cfcA:
30.9		 1uayB-2cfcA:
36.09
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.
1VQ1_A_SAMA301_1
(N5-GLUTAMINE
METHYLTRANSFERASE,
HEMK)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		3 / 3 GLY A   9
ASP A  33
ASN A  14
 NAD  A1251 (-3.5A)
NAD  A1251 (-2.7A)
NAD  A1251 (-2.7A)
 0.58A 1vq1A-2cfcA:
6.6		 1vq1A-2cfcA:
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.
2BM9_E_SAME301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 12 GLY A   9
ASP A  33
ASP A  60
ASN A  87
ALA A  88
 NAD  A1251 (-3.5A)
NAD  A1251 (-2.7A)
NAD  A1251 (-3.4A)
NAD  A1251 (-2.8A)
NAD  A1251 (-3.6A)
 0.96A 2bm9E-2cfcA:
5.9		 2bm9E-2cfcA:
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.
2NNI_A_MTKA501_1
(CYTOCHROME P450 2C8)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 12 THR A 190
ASN A 114
VAL A 221
ALA A 222
VAL A 138
 NAD  A1251 (-2.7A)
None
None
None
None
 1.09A 2nniA-2cfcA:
undetectable		 2nniA-2cfcA:
18.39
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.
2PYN_A_1UNA1001_3
(PROTEASE RETROPEPSIN)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		3 / 3 ASP A 223
THR A 190
PRO A 191
 None
NAD  A1251 (-2.7A)
NAD  A1251 (-3.1A)
 0.66A 2pynB-2cfcA:
undetectable		 2pynB-2cfcA:
18.18
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.
2QAK_A_1UNA1001_4
(PROTEASE RETROPEPSIN)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		3 / 3 ASP A 223
THR A 190
PRO A 191
 None
NAD  A1251 (-2.7A)
NAD  A1251 (-3.1A)
 0.65A 2qakB-2cfcA:
undetectable		 2qakB-2cfcA:
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.
2V7B_A_BEZA1529_0
(BENZOATE-COENZYME A
LIGASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 9 ALA A 249
TYR A 247
GLY A 186
GLY A 245
ILE A 210
 None
None
KPC  A1252 (-4.7A)
None
None
 1.04A 2v7bA-2cfcA:
4.4		 2v7bA-2cfcA:
21.44
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.
2V7B_B_BEZB1529_0
(BENZOATE-COENZYME A
LIGASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 9 ALA A 249
TYR A 247
GLY A 186
GLY A 245
ILE A 210
 None
None
KPC  A1252 (-4.7A)
None
None
 1.02A 2v7bB-2cfcA:
3.4		 2v7bB-2cfcA:
21.44
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.
3HCR_A_CHDA424_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		4 / 8 PRO A 185
SER A 142
GLY A 216
MET A 187
 NAD  A1251 (-3.5A)
KPC  A1252 (-3.5A)
None
NAD  A1251 (-3.8A)
 1.09A 3hcrA-2cfcA:
3.4		 3hcrA-2cfcA:
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.
3Q87_B_SAMB300_0
(N6 ADENINE SPECIFIC
DNA METHYLASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 12 GLY A   9
ILE A  18
ASP A  33
LEU A  34
ASP A  60
 NAD  A1251 (-3.5A)
None
NAD  A1251 (-2.7A)
NAD  A1251 (-4.2A)
NAD  A1251 (-3.4A)
 0.67A 3q87B-2cfcA:
6.8		 3q87B-2cfcA:
21.57
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.
3VQR_A_ACTA1002_0
(PUTATIVE
OXIDOREDUCTASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		4 / 6 ASP A  60
GLY A 117
VAL A 113
THR A   8
 NAD  A1251 (-3.4A)
None
NAD  A1251 ( 4.1A)
None
 1.13A 3vqrA-2cfcA:
4.3		 3vqrA-2cfcA:
22.13
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.
3VQR_B_ACTB1002_0
(PUTATIVE
OXIDOREDUCTASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		4 / 5 ASP A  60
GLY A 117
VAL A 113
THR A   8
 NAD  A1251 (-3.4A)
None
NAD  A1251 ( 4.1A)
None
 1.15A 3vqrB-2cfcA:
6.2		 3vqrB-2cfcA:
22.13
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.
4DUB_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 9D7)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		4 / 6 ALA A  62
GLY A  65
LEU A 120
VAL A  67
 NAD  A1251 ( 4.9A)
None
None
None
 1.01A 4dubA-2cfcA:
undetectable		 4dubA-2cfcA:
21.62
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.
4E1G_B_LNLB701_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		4 / 7 VAL A 221
VAL A 225
LEU A 228
VAL A 136
 None
 0.98A 4e1gB-2cfcA:
undetectable		 4e1gB-2cfcA:
15.92
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.
4EAT_B_BEZB1000_0
(BENZOATE-COENZYME A
LIGASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 9 ALA A 249
TYR A 247
GLY A 186
GLY A 245
ILE A 210
 None
None
KPC  A1252 (-4.7A)
None
None
 1.05A 4eatB-2cfcA:
undetectable		 4eatB-2cfcA:
19.89
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.
4WNU_D_QDND602_1
(CYTOCHROME P450 2D6)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 10 GLY A 186
LEU A 241
ALA A 224
ASP A 223
ALA A 219
 KPC  A1252 (-4.7A)
None
None
None
None
 1.13A 4wnuD-2cfcA:
undetectable		 4wnuD-2cfcA:
20.17
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.
5BXN_V_BO2V301_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-3)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 11 THR A 193
GLN A 194
GLY A 216
THR A 217
ALA A 218
 NAD  A1251 (-3.3A)
None
None
None
None
 1.36A 5bxnV-2cfcA:
undetectable
5bxnW-2cfcA:
undetectable		 5bxnV-2cfcA:
25.09
5bxnW-2cfcA:
23.46
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.
5CSW_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		3 / 3 PHE A  22
ILE A  18
ASP A  33
 None
None
NAD  A1251 (-2.7A)
 0.75A 5cswB-2cfcA:
undetectable		 5cswB-2cfcA:
21.52
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.
5MRA_B_DM2B204_1
(SORCIN)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		4 / 6 TYR A  50
THR A  20
ASP A  27
GLY A  26
 None
 1.26A 5mraA-2cfcA:
undetectable
5mraB-2cfcA:
undetectable		 5mraA-2cfcA:
21.60
5mraB-2cfcA:
21.60
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.
6DH0_A_017A101_0
(PROTEASE)		 2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE
(Xanthobacter
autotrophicus) 		5 / 12 GLY A 230
ALA A 229
VAL A  85
ILE A  18
VAL A  83
 None
 0.99A 6dh0A-2cfcA:
undetectable		 6dh0A-2cfcA:
15.26