SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3zdr'

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.
1BZM_A_MZMA262_1
(CARBONIC ANHYDRASE I)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 HIS A 744
HIS A 730
THR A 664
HIS A 665
 ZN  A1870 ( 3.3A)
ZN  A1870 ( 3.2A)
None
ZN  A1870 ( 3.2A)
 0.96A 1bzmA-3zdrA:
undetectable		 1bzmA-3zdrA:
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.
1DMI_A_BHSA1610_1
(NITRIC OXIDE
SYNTHASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 SER A 801
VAL A 803
ALA A 785
GLU A 800
 None
 1.06A 1dmiA-3zdrA:
undetectable
1dmiB-3zdrA:
undetectable		 1dmiA-3zdrA:
21.16
1dmiB-3zdrA:
21.16
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.
1EI6_C_PPFC413_1
(PHOSPHONOACETATE
HYDROLASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		5 / 8 THR A 664
ASP A 661
HIS A 744
HIS A 665
HIS A 730
 None
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.3A)
ZN  A1870 ( 3.2A)
ZN  A1870 ( 3.2A)
 1.49A 1ei6C-3zdrA:
undetectable		 1ei6C-3zdrA:
23.22
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.
1JGL_L_ESTL911_1
(IG GAMMA-1-CHAIN
IG KAPPA-CHAIN)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		5 / 10 GLY A 737
ALA A 865
LEU A 751
TYR A 862
PHE A 829
 None
 1.49A 1jglH-3zdrA:
undetectable
1jglL-3zdrA:
undetectable		 1jglH-3zdrA:
16.70
1jglL-3zdrA:
17.60
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.
1MJ2_A_SAMA2201_1
(PROTEIN (METHIONINE
REPRESSOR))		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 HIS A 754
ALA A 865
PHE A 866
GLY A 868
 None
 0.89A 1mj2B-3zdrA:
undetectable		 1mj2B-3zdrA:
12.21
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.
1MJ2_C_SAMC1200_1
(PROTEIN (METHIONINE
REPRESSOR))		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 HIS A 754
ALA A 865
PHE A 866
GLY A 868
 None
 0.89A 1mj2D-3zdrA:
undetectable		 1mj2D-3zdrA:
12.21
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.
1MJO_A_SAMA199_1
(METHIONINE REPRESSOR)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 HIS A 754
ALA A 865
PHE A 866
GLY A 868
 None
 0.88A 1mjoB-3zdrA:
undetectable		 1mjoB-3zdrA:
12.21
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.
1MJO_B_SAMB200_0
(METHIONINE REPRESSOR)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 HIS A 754
ALA A 865
PHE A 866
GLY A 868
 None
 0.93A 1mjoA-3zdrA:
undetectable		 1mjoA-3zdrA:
12.21
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.
1MJO_D_SAMD200_1
(METHIONINE REPRESSOR)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 HIS A 754
ALA A 865
PHE A 866
GLY A 868
 None
 0.88A 1mjoD-3zdrA:
undetectable		 1mjoD-3zdrA:
12.21
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.
1NW3_A_SAMA500_0
(HISTONE
METHYLTRANSFERASE
DOT1L)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		5 / 12 GLU A 531
ASP A 538
GLY A 536
ALA A 559
PHE A 489
 None
 1.26A 1nw3A-3zdrA:
2.3		 1nw3A-3zdrA:
23.24
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.
1NW3_A_SAMA500_0
(HISTONE
METHYLTRANSFERASE
DOT1L)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		5 / 12 GLU A 531
ASP A 538
GLY A 536
ALA A 562
PHE A 489
 None
 1.29A 1nw3A-3zdrA:
2.3		 1nw3A-3zdrA:
23.24
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.
1SG9_A_SAMA301_0
(HEMK PROTEIN)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		5 / 12 PHE A 721
ILE A 687
ILE A 716
VAL A 671
SER A 672
 GOL  A1872 (-4.2A)
None
None
None
None
 1.11A 1sg9A-3zdrA:
undetectable		 1sg9A-3zdrA:
22.07
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.
2FB2_B_SAMB501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 7 TYR A 862
GLU A 668
THR A 846
SER A 731
 None
None
CSO  A 845 ( 4.4A)
CSO  A 845 ( 2.5A)
 1.21A 2fb2B-3zdrA:
2.5		 2fb2B-3zdrA:
20.35
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.
2Y00_B_Y00B601_2
(BETA-1 ADRENERGIC
RECEPTOR)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 VAL A 613
ASN A 723
TRP A 462
 None
 0.78A 2y00B-3zdrA:
undetectable		 2y00B-3zdrA:
21.33
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.
3GLQ_A_RABA602_2
(ADENOSYLHOMOCYSTEINA
SE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 5 GLN A 844
THR A 846
GLU A 668
THR A 664
 CSO  A 845 ( 3.4A)
CSO  A 845 ( 4.4A)
None
None
 1.33A 3glqA-3zdrA:
3.1		 3glqA-3zdrA:
24.46
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.
3IA4_C_MTXC164_2
(DIHYDROFOLATE
REDUCTASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 ILE A 603
ARG A 510
ILE A 549
THR A 605
 None
 1.22A 3ia4C-3zdrA:
undetectable		 3ia4C-3zdrA:
17.32
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.
3LSL_A_PZIA801_0
(GLUTAMATE RECEPTOR 2)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 ILE A 861
SER A 731
PRO A 853
ASN A 759
 None
CSO  A 845 ( 2.5A)
None
None
 0.95A 3lslA-3zdrA:
undetectable
3lslD-3zdrA:
undetectable		 3lslA-3zdrA:
20.40
3lslD-3zdrA:
20.40
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.
3LSL_D_PZID801_0
(GLUTAMATE RECEPTOR 2)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 PRO A 853
ASN A 759
ILE A 861
SER A 731
 None
None
None
CSO  A 845 ( 2.5A)
 0.90A 3lslA-3zdrA:
undetectable
3lslD-3zdrA:
undetectable		 3lslA-3zdrA:
20.40
3lslD-3zdrA:
20.40
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.
3P4W_C_DSFC320_1
(GLR4197 PROTEIN)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 ILE A 807
ILE A 806
VAL A 869
ILE A 756
 None
 0.86A 3p4wC-3zdrA:
undetectable		 3p4wC-3zdrA:
25.66
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.
3R2J_C_NIOC311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		5 / 12 LEU A 726
ASP A 661
HIS A 744
HIS A 730
ALA A 717
 CSO  A 845 ( 4.1A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.3A)
ZN  A1870 ( 3.2A)
None
 1.21A 3r2jC-3zdrA:
2.2		 3r2jC-3zdrA:
21.40
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.
3T3S_D_9PLD1_1
(CYTOCHROME P450 2A13)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 ALA A 848
ASN A 673
ALA A 675
THR A 679
 CSO  A 845 ( 3.9A)
None
None
None
 0.82A 3t3sD-3zdrA:
undetectable		 3t3sD-3zdrA:
23.01
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.
3T3S_E_9PLE1_1
(CYTOCHROME P450 2A13)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 ALA A 848
ASN A 673
ALA A 675
THR A 679
 CSO  A 845 ( 3.9A)
None
None
None
 0.89A 3t3sE-3zdrA:
undetectable		 3t3sE-3zdrA:
23.01
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.
3T3S_F_9PLF1_1
(CYTOCHROME P450 2A13)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 ALA A 848
ASN A 673
ALA A 675
THR A 679
 CSO  A 845 ( 3.9A)
None
None
None
 0.94A 3t3sF-3zdrA:
undetectable		 3t3sF-3zdrA:
23.01
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_A_LNLA701_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 5 VAL A 799
LEU A 802
SER A 801
MET A 752
 None
 1.37A 4e1gA-3zdrA:
undetectable		 4e1gA-3zdrA:
22.35
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.
4N09_C_ADNC401_2
(ADENOSINE KINASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 5 ASN A 712
LEU A 689
SER A 714
LEU A 694
 None
 1.07A 4n09C-3zdrA:
3.5		 4n09C-3zdrA:
22.82
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.
4RFQ_A_SAMA401_1
(HISTIDINE PROTEIN
METHYLTRANSFERASE 1
HOMOLOG)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 THR A 614
GLY A 608
ASP A 661
SER A 611
 None
None
ZN  A1870 ( 1.7A)
None
 1.34A 4rfqA-3zdrA:
2.9		 4rfqA-3zdrA:
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.
5DQY_A_BEZA401_0
(THIOREDOXIN)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 ILE A 819
VAL A 824
SER A 831
GLU A 830
 None
 1.07A 5dqyA-3zdrA:
undetectable		 5dqyA-3zdrA:
12.47
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.
5HIE_C_P06C801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 7 ILE A 728
VAL A 824
ILE A 750
PHE A 740
 None
 0.74A 5hieC-3zdrA:
undetectable		 5hieC-3zdrA:
24.21
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.
5I9Y_A_1N1A1001_2
(EPHRIN TYPE-A
RECEPTOR 2)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 ILE A 548
ILE A 485
MET A 540
 None
 0.56A 5i9yA-3zdrA:
undetectable		 5i9yA-3zdrA:
20.14
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.
5JW1_A_CELA602_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 6 LEU A 858
SER A 856
ARG A 863
ILE A 861
 None
 1.03A 5jw1A-3zdrA:
undetectable		 5jw1A-3zdrA:
22.72
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.
5KB5_A_ADNA401_2
(ADENOSINE KINASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 ASN A 712
LEU A 689
SER A 714
LEU A 694
 None
 1.09A 5kb5A-3zdrA:
3.4		 5kb5A-3zdrA:
26.39
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.
5OEX_A_CUA601_0
(THIOCYANATE
DEHYDROGENASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 HIS A 665
ASP A 661
HIS A 744
 ZN  A1870 ( 3.2A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.3A)
 0.73A 5oexA-3zdrA:
undetectable		 5oexA-3zdrA:
22.24
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.
5OEX_A_CUA601_0
(THIOCYANATE
DEHYDROGENASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 HIS A 744
ASP A 661
HIS A 665
 ZN  A1870 ( 3.3A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.2A)
 0.43A 5oexA-3zdrA:
undetectable		 5oexA-3zdrA:
22.24
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.
5OEX_B_CUB601_0
(THIOCYANATE
DEHYDROGENASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 HIS A 665
ASP A 661
HIS A 744
 ZN  A1870 ( 3.2A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.3A)
 0.73A 5oexB-3zdrA:
undetectable		 5oexB-3zdrA:
22.24
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.
5OEX_B_CUB601_0
(THIOCYANATE
DEHYDROGENASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 HIS A 744
ASP A 661
HIS A 665
 ZN  A1870 ( 3.3A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.2A)
 0.43A 5oexB-3zdrA:
undetectable		 5oexB-3zdrA:
22.24
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.
5OEX_C_CUC601_0
(THIOCYANATE
DEHYDROGENASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 HIS A 665
ASP A 661
HIS A 744
 ZN  A1870 ( 3.2A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.3A)
 0.70A 5oexC-3zdrA:
undetectable		 5oexC-3zdrA:
22.24
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.
5OEX_C_CUC601_0
(THIOCYANATE
DEHYDROGENASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 HIS A 744
ASP A 661
HIS A 665
 ZN  A1870 ( 3.3A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.2A)
 0.43A 5oexC-3zdrA:
undetectable		 5oexC-3zdrA:
22.24
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.
5OEX_D_CUD601_0
(THIOCYANATE
DEHYDROGENASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 HIS A 665
ASP A 661
HIS A 744
 ZN  A1870 ( 3.2A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.3A)
 0.68A 5oexD-3zdrA:
undetectable		 5oexD-3zdrA:
22.24
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.
5OEX_D_CUD601_0
(THIOCYANATE
DEHYDROGENASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 HIS A 744
ASP A 661
HIS A 665
 ZN  A1870 ( 3.3A)
ZN  A1870 ( 1.7A)
ZN  A1870 ( 3.2A)
 0.44A 5oexD-3zdrA:
undetectable		 5oexD-3zdrA:
22.24
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.
5TT3_H_EZLH303_1
(ALPHA-CARBONIC
ANHYDRASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 8 HIS A 744
HIS A 730
LEU A 751
ALA A 747
 ZN  A1870 ( 3.3A)
ZN  A1870 ( 3.2A)
None
None
 0.93A 5tt3H-3zdrA:
undetectable		 5tt3H-3zdrA:
22.01
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.
5ZW4_A_SAMA302_0
(PUTATIVE
O-METHYLTRANSFERASE
YRRM)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		5 / 12 PRO A 763
GLU A 796
ALA A 761
ASN A 759
ALA A 782
 None
 1.01A 5zw4A-3zdrA:
undetectable		 5zw4A-3zdrA:
19.91
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.
6ECF_I_DVAI3010_0
(VLM2
DODECADEPSIPEPTIDE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		3 / 3 PHE A 829
ARG A 863
ALA A 837
 None
 0.89A 6ecfB-3zdrA:
5.2		 6ecfB-3zdrA:
23.53
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.
6GTQ_A_ACTA205_0
(N-ACETYLTRANSFERASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 ALA A 666
ALA A 669
ALA A 683
ALA A 686
 None
 0.62A 6gtqA-3zdrA:
undetectable
6gtqB-3zdrA:
undetectable		 6gtqA-3zdrA:
16.55
6gtqB-3zdrA:
16.55
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.
6GTQ_A_ACTA205_0
(N-ACETYLTRANSFERASE)		 3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE
(Parageobacillus
thermoglucosidas
ius) 		4 / 4 ALA A 683
ALA A 686
ALA A 666
ALA A 669
 None
 0.62A 6gtqA-3zdrA:
undetectable
6gtqB-3zdrA:
undetectable		 6gtqA-3zdrA:
16.55
6gtqB-3zdrA:
16.55