SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2hsd'

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.
1U70_A_MTXA187_2
(DIHYDROFOLATE
REDUCTASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		4 / 4 SER A 138
ILE A 137
VAL A 239
THR A 205
 None
NAD  A 256 (-4.6A)
None
None
 1.14A 1u70A-2hsdA:
2.1		 1u70A-2hsdA:
21.03
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)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		6 / 11 GLY A  13
ALA A  15
ASP A  37
ASP A  60
VAL A  61
ALA A  88
 NAD  A 256 (-3.2A)
NAD  A 256 ( 3.8A)
NAD  A 256 (-2.7A)
NAD  A 256 (-4.2A)
NAD  A 256 (-4.0A)
NAD  A 256 (-3.2A)
 0.51A 1uayA-2hsdA:
29.4		 1uayA-2hsdA:
36.68
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)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		6 / 10 GLY A  13
ALA A  15
ASP A  37
ASP A  60
VAL A  61
ALA A  88
 NAD  A 256 (-3.2A)
NAD  A 256 ( 3.8A)
NAD  A 256 (-2.7A)
NAD  A 256 (-4.2A)
NAD  A 256 (-4.0A)
NAD  A 256 (-3.2A)
 0.49A 1uayB-2hsdA:
30.0		 1uayB-2hsdA:
36.68
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.
1XDK_E_9CRE1500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 12 ILE A  11
ALA A  36
GLN A  57
TRP A  67
VAL A 221
 None
 1.05A 1xdkE-2hsdA:
undetectable		 1xdkE-2hsdA:
22.26
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)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 12 GLY A  13
ASP A  37
ASP A  60
ASN A  87
ALA A  88
 NAD  A 256 (-3.2A)
NAD  A 256 (-2.7A)
NAD  A 256 (-4.2A)
NAD  A 256 (-3.2A)
NAD  A 256 (-3.2A)
 0.89A 2bm9E-2hsdA:
6.1		 2bm9E-2hsdA:
23.83
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.
2NYU_B_SAMB201_0
(PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 12 GLY A  13
ALA A  15
LEU A  39
VAL A  61
THR A  62
 NAD  A 256 (-3.2A)
NAD  A 256 ( 3.8A)
NAD  A 256 (-3.8A)
NAD  A 256 (-4.0A)
NAD  A 256 ( 4.9A)
 0.95A 2nyuB-2hsdA:
8.6		 2nyuB-2hsdA:
24.22
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.
2ZW9_B_SAMB801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 2)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		4 / 8 ILE A 137
ASN A 111
SER A 155
SER A 139
 NAD  A 256 (-4.6A)
None
None
NAD  A 256 (-3.4A)
 1.11A 2zw9B-2hsdA:
5.8		 2zw9B-2hsdA:
15.56
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.
3G9E_A_RO7A1_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 12 GLY A  19
LEU A 225
VAL A 135
ILE A 137
LEU A  50
 NAD  A 256 (-4.5A)
None
None
NAD  A 256 (-4.6A)
None
 1.22A 3g9eA-2hsdA:
undetectable		 3g9eA-2hsdA:
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.
3HCR_A_CHDA424_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		4 / 8 PRO A 182
SER A 139
GLY A 211
MET A 184
 NAD  A 256 (-4.0A)
NAD  A 256 (-3.4A)
None
None
 1.12A 3hcrA-2hsdA:
2.9		 3hcrA-2hsdA:
20.82
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.
3T3C_A_017A201_2
(HIV-1 PROTEASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 10 ILE A 134
GLY A 118
PRO A 124
ALA A 125
VAL A  81
 None
 0.92A 3t3cB-2hsdA:
undetectable		 3t3cB-2hsdA:
16.33
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.
3UQ6_B_ADNB401_2
(ADENOSINE KINASE,
PUTATIVE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		4 / 5 LEU A 165
GLY A 161
MET A 119
ASN A 136
 None
 1.27A 3uq6B-2hsdA:
6.1		 3uq6B-2hsdA:
21.08
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.
4EAT_A_BEZA1000_0
(BENZOATE-COENZYME A
LIGASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		4 / 7 ALA A  88
GLY A  17
GLY A  14
ILE A  11
 NAD  A 256 (-3.2A)
NAD  A 256 (-3.1A)
None
None
 0.65A 4eatA-2hsdA:
3.7		 4eatA-2hsdA:
20.04
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.
4UDC_A_DEXA1778_2
(GLUCOCORTICOID
RECEPTOR)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		3 / 3 MET A 207
GLN A 197
TYR A 186
 None
 0.81A 4udcA-2hsdA:
undetectable		 4udcA-2hsdA:
21.45
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.
4YB6_A_HISA302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 10 GLY A 161
VAL A 159
HIS A 181
LEU A 143
SER A 179
 None
 1.26A 4yb6A-2hsdA:
undetectable
4yb6E-2hsdA:
undetectable		 4yb6A-2hsdA:
20.39
4yb6E-2hsdA:
20.39
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.
4YB6_B_HISB302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 10 GLY A 161
VAL A 159
HIS A 181
LEU A 143
SER A 179
 None
 1.26A 4yb6B-2hsdA:
undetectable
4yb6C-2hsdA:
undetectable		 4yb6B-2hsdA:
20.39
4yb6C-2hsdA:
20.39
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.
4YB6_C_HISC302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 10 GLY A 161
VAL A 159
HIS A 181
LEU A 143
SER A 179
 None
 1.25A 4yb6C-2hsdA:
undetectable
4yb6F-2hsdA:
undetectable		 4yb6C-2hsdA:
20.39
4yb6F-2hsdA:
20.39
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.
4YB6_D_HISD302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 10 HIS A 181
LEU A 143
SER A 179
GLY A 161
VAL A 159
 None
 1.24A 4yb6A-2hsdA:
undetectable
4yb6D-2hsdA:
undetectable		 4yb6A-2hsdA:
20.39
4yb6D-2hsdA:
20.39
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.
4YB6_E_HISE302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 10 HIS A 181
LEU A 143
SER A 179
GLY A 161
VAL A 159
 None
 1.26A 4yb6D-2hsdA:
undetectable
4yb6E-2hsdA:
undetectable		 4yb6D-2hsdA:
20.39
4yb6E-2hsdA:
20.39
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.
4YB6_F_HISF302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 10 HIS A 181
LEU A 143
SER A 179
GLY A 161
VAL A 159
 None
 1.26A 4yb6B-2hsdA:
undetectable
4yb6F-2hsdA:
undetectable		 4yb6B-2hsdA:
20.39
4yb6F-2hsdA:
20.39
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.
5L94_A_TESA502_1
(CYTOCHROME P450)		 2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE
(Streptomyces
exfoliatus) 		5 / 8 VAL A 180
ILE A 217
ALA A 218
VAL A  85
VAL A 135
 None
 0.91A 5l94A-2hsdA:
undetectable		 5l94A-2hsdA:
19.33