SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3zhr'

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.
1D4F_C_ADNC603_2
(S-ADENOSYLHOMOCYSTEI
NE HYDROLASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 5 GLU A 468
THR A 469
HIS A 471
LEU A 723
None
1.26A 1d4fC-3zhrA:
2.9
1d4fC-3zhrA:
20.37
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.
1EKJ_H_ACTH3006_0
(BETA-CARBONIC
ANHYDRASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 6 GLN A1061
ASP A1004
VAL A 971
HIS A1055
CA  A2003 ( 4.8A)
CA  A2003 (-2.1A)
None
CA  A2003 (-4.1A)
1.33A 1ekjG-3zhrA:
4.7
1ekjH-3zhrA:
4.4
1ekjG-3zhrA:
13.82
1ekjH-3zhrA:
13.82
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.
1FAP_A_RAPA108_2
(FK506-BINDING
PROTEIN
FRAP)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 LEU A 723
ARG A 728
PHE A 731
TRP A 462
None
0.81A 1fapB-3zhrA:
undetectable
1fapB-3zhrA:
8.30
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.
1MX1_B_THAB2_1
(LIVER
CARBOXYLESTERASE I)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 11 VAL A1006
LEU A1008
LEU A 927
LEU A 883
MET A 970
None
1.22A 1mx1B-3zhrA:
undetectable
1mx1B-3zhrA:
21.19
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.
1S3Z_B_RIOB501_0
(AMINOGLYCOSIDE
6'-N-ACETYLTRANSFERA
SE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 GLU A 923
VAL A 914
ARG A 667
GLU A 629
None
1.27A 1s3zA-3zhrA:
undetectable
1s3zB-3zhrA:
undetectable
1s3zA-3zhrA:
11.11
1s3zB-3zhrA:
11.11
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.
1V54_C_CHDC3271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE III
CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.91A 1v54C-3zhrA:
undetectable
1v54J-3zhrA:
undetectable
1v54C-3zhrA:
14.22
1v54J-3zhrA:
6.02
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.
1V54_P_CHDP4271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE III
CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.90A 1v54P-3zhrA:
undetectable
1v54W-3zhrA:
undetectable
1v54P-3zhrA:
14.22
1v54W-3zhrA:
6.02
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.
1X7P_A_SAMA301_0
(RRNA
METHYLTRANSFERASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 11 GLU A 892
GLY A 940
MET A 839
LEU A 930
ALA A 931
None
1.01A 1x7pA-3zhrA:
undetectable
1x7pB-3zhrA:
undetectable
1x7pA-3zhrA:
15.30
1x7pB-3zhrA:
15.30
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.
2DYR_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.90A 2dyrC-3zhrA:
undetectable
2dyrJ-3zhrA:
undetectable
2dyrC-3zhrA:
14.22
2dyrJ-3zhrA:
6.02
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.
2DYR_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.90A 2dyrP-3zhrA:
undetectable
2dyrW-3zhrA:
undetectable
2dyrP-3zhrA:
14.22
2dyrW-3zhrA:
6.02
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.
2DYS_C_CHDC310_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
LEU A1184
PHE A1192
None
MPD  A2228 (-3.2A)
None
None
1.03A 2dysC-3zhrA:
undetectable
2dysJ-3zhrA:
undetectable
2dysC-3zhrA:
14.22
2dysJ-3zhrA:
6.02
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.
2EIK_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.89A 2eikC-3zhrA:
undetectable
2eikJ-3zhrA:
undetectable
2eikC-3zhrA:
14.22
2eikJ-3zhrA:
6.02
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.
2EIK_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.85A 2eikP-3zhrA:
undetectable
2eikW-3zhrA:
undetectable
2eikP-3zhrA:
14.22
2eikW-3zhrA:
6.02
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.
2EIL_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.90A 2eilC-3zhrA:
undetectable
2eilJ-3zhrA:
undetectable
2eilC-3zhrA:
14.22
2eilJ-3zhrA:
6.02
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.
2YZQ_A_SAMA6075_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN PH1780)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 ASP A 738
THR A 696
ARG A 690
ILE A 387
PRO A 389
None
1.24A 2yzqA-3zhrA:
undetectable
2yzqA-3zhrA:
15.65
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.
2ZXW_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
LEU A1184
PHE A1192
None
MPD  A2228 (-3.2A)
None
None
0.98A 2zxwC-3zhrA:
undetectable
2zxwJ-3zhrA:
undetectable
2zxwC-3zhrA:
14.22
2zxwJ-3zhrA:
6.02
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.
3AG2_C_CHDC271_0
(CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.86A 3ag2C-3zhrA:
undetectable
3ag2C-3zhrA:
14.22
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.
3AG2_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.84A 3ag2P-3zhrA:
undetectable
3ag2W-3zhrA:
undetectable
3ag2P-3zhrA:
14.22
3ag2W-3zhrA:
6.02
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.
3AG4_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.92A 3ag4C-3zhrA:
undetectable
3ag4J-3zhrA:
undetectable
3ag4C-3zhrA:
14.22
3ag4J-3zhrA:
6.02
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.
3AG4_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.94A 3ag4P-3zhrA:
undetectable
3ag4W-3zhrA:
undetectable
3ag4P-3zhrA:
14.22
3ag4W-3zhrA:
6.02
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.
3ASN_C_CHDC271_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.91A 3asnC-3zhrA:
undetectable
3asnJ-3zhrA:
undetectable
3asnC-3zhrA:
14.22
3asnJ-3zhrA:
6.02
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.
3CCF_B_BEZB261_0
(CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 ASN A 678
ILE A 680
PHE A 682
ARG A 540
MG  A2002 ( 2.7A)
None
None
TPP  A2001 (-3.7A)
1.14A 3ccfB-3zhrA:
2.5
3ccfB-3zhrA:
16.11
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.
3EEY_A_SAMA300_0
(PUTATIVE RRNA
METHYLASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 THR A 671
GLY A 669
ILE A 702
HIS A 673
THR A 657
None
1.13A 3eeyA-3zhrA:
undetectable
3eeyA-3zhrA:
12.62
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.
3EEY_D_SAMD300_0
(PUTATIVE RRNA
METHYLASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 GLY A 711
ASN A 710
ASP A 738
ASN A 677
PRO A 389
None
1.19A 3eeyD-3zhrA:
undetectable
3eeyD-3zhrA:
12.62
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.
3EEY_E_SAME300_0
(PUTATIVE RRNA
METHYLASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 THR A 671
GLY A 669
ILE A 702
HIS A 673
THR A 657
None
1.14A 3eeyE-3zhrA:
undetectable
3eeyE-3zhrA:
12.62
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.
3EEY_J_SAMJ300_0
(PUTATIVE RRNA
METHYLASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 THR A 671
GLY A 669
ILE A 702
HIS A 673
THR A 657
None
1.12A 3eeyJ-3zhrA:
undetectable
3eeyJ-3zhrA:
12.62
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.
3ELZ_A_CHDA150_0
(ILEAL BILE
ACID-BINDING PROTEIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 VAL A 725
VAL A 545
LEU A 599
ILE A 549
TYR A 586
None
1.41A 3elzA-3zhrA:
undetectable
3elzA-3zhrA:
10.77
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.
3ELZ_B_CHDB150_0
(ILEAL BILE
ACID-BINDING PROTEIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 11 VAL A 725
VAL A 545
LEU A 599
ILE A 549
TYR A 586
None
1.45A 3elzB-3zhrA:
undetectable
3elzB-3zhrA:
10.77
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.
3ELZ_C_CHDC150_0
(ILEAL BILE
ACID-BINDING PROTEIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 VAL A 725
VAL A 545
LEU A 599
ILE A 549
TYR A 586
None
1.40A 3elzC-3zhrA:
undetectable
3elzC-3zhrA:
10.77
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.
3F8W_B_ADNB301_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 SER A 899
GLY A 961
VAL A 612
GLY A 957
VAL A 971
None
1.26A 3f8wB-3zhrA:
undetectable
3f8wB-3zhrA:
16.90
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.
3K2H_B_LYAB514_2
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
3 / 3 ARG A1150
THR A1183
THR A1038
None
None
MPD  A2228 ( 3.9A)
0.72A 3k2hB-3zhrA:
undetectable
3k2hB-3zhrA:
19.79
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.
3MIH_A_CUA358_0
(PEPTIDYL-GLYCINE
ALPHA-AMIDATING
MONOOXYGENASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
3 / 3 HIS A 643
HIS A 673
MET A 641
None
0.73A 3mihA-3zhrA:
undetectable
3mihA-3zhrA:
16.13
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.
3RF4_A_FUNA201_1
(MACROPHAGE MIGRATION
INHIBITORY FACTOR)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 11 MET A 517
VAL A 709
PHE A 707
VAL A 447
ILE A 737
None
1.23A 3rf4A-3zhrA:
undetectable
3rf4C-3zhrA:
undetectable
3rf4A-3zhrA:
8.20
3rf4C-3zhrA:
8.20
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.
3RF4_B_FUNB202_1
(MACROPHAGE MIGRATION
INHIBITORY FACTOR)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 11 ILE A 737
MET A 517
VAL A 709
PHE A 707
VAL A 447
None
1.19A 3rf4A-3zhrA:
undetectable
3rf4B-3zhrA:
undetectable
3rf4A-3zhrA:
8.20
3rf4B-3zhrA:
8.20
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.
3RF4_C_FUNC203_1
(MACROPHAGE MIGRATION
INHIBITORY FACTOR)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 11 ILE A 737
MET A 517
VAL A 709
PHE A 707
VAL A 447
None
1.22A 3rf4B-3zhrA:
undetectable
3rf4C-3zhrA:
undetectable
3rf4B-3zhrA:
8.20
3rf4C-3zhrA:
8.20
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.
3SUE_D_SUED1201_1
(NS3 PROTEASE, NS4A
PROTEIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 HIS A 847
GLY A 844
GLY A 887
PHE A 943
ALA A 913
None
1.22A 3sueD-3zhrA:
undetectable
3sueD-3zhrA:
14.57
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.
3X2Q_C_CHDC304_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.95A 3x2qC-3zhrA:
undetectable
3x2qJ-3zhrA:
undetectable
3x2qC-3zhrA:
14.22
3x2qJ-3zhrA:
6.02
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.
3X2Q_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.97A 3x2qP-3zhrA:
undetectable
3x2qW-3zhrA:
undetectable
3x2qP-3zhrA:
14.22
3x2qW-3zhrA:
6.02
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.
4ACB_C_DXCC1478_0
(TRANSLATION
ELONGATION FACTOR
SELB)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 6 THR A1038
ILE A1039
THR A1183
PHE A1180
MPD  A2228 ( 3.9A)
None
None
None
1.04A 4acbC-3zhrA:
3.4
4acbC-3zhrA:
20.02
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.
4D7B_B_TCWB1126_1
(TRANSTHYRETIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1123
ALA A1225
LEU A1222
THR A1224
None
0.97A 4d7bA-3zhrA:
undetectable
4d7bA-3zhrA:
11.14
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.
4G5J_A_0WMA1102_1
(EPIDERMAL GROWTH
FACTOR RECEPTOR)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 HIS A 912
ILE A 915
PRO A 862
HIS A 857
None
1.19A 4g5jA-3zhrA:
undetectable
4g5jA-3zhrA:
15.54
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.
4IKI_A_IMNA201_1
(TRANSTHYRETIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
3 / 3 LYS A 620
LEU A 616
ALA A 619
None
0.72A 4ikiA-3zhrA:
undetectable
4ikiA-3zhrA:
10.56
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.
4L3G_F_ACTF401_0
(METHYLAMINE
DEHYDROGENASE HEAVY
CHAIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
3 / 3 ARG A1091
LEU A1094
GLU A1095
None
0.72A 4l3gF-3zhrA:
undetectable
4l3gF-3zhrA:
18.76
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.
4M5M_A_DX4A401_0
(2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 GLY A 615
THR A 657
LEU A 663
ARG A 618
None
1.25A 4m5mA-3zhrA:
undetectable
4m5mA-3zhrA:
11.20
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.
4MV7_A_PPFA501_1
(BIOTIN CARBOXYLASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LYS A1118
ARG A1200
GLN A1218
GLU A1122
None
1.23A 4mv7A-3zhrA:
undetectable
4mv7A-3zhrA:
20.00
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.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 ASN A 710
VAL A 709
LEU A 508
LEU A 486
ASP A 712
None
1.16A 4qckA-3zhrA:
undetectable
4qckA-3zhrA:
19.43
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.
4RYA_A_MTLA501_0
(ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (SORBITOL))
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 ARG A 867
ALA A 879
ALA A 913
VAL A 914
GLN A 910
None
1.43A 4ryaA-3zhrA:
undetectable
4ryaA-3zhrA:
19.58
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.
4XQG_A_AG2A505_1
(HOMOSPERMIDINE
SYNTHASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 ARG A1091
ASP A1101
ASP A1081
ASP A1084
None
1.11A 4xqgA-3zhrA:
undetectable
4xqgA-3zhrA:
20.05
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.
4XQG_B_AG2B505_1
(HOMOSPERMIDINE
SYNTHASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 8 ARG A1091
ASP A1101
ASP A1081
ASP A1084
None
1.12A 4xqgB-3zhrA:
undetectable
4xqgB-3zhrA:
20.05
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.
4ZZB_E_ACTE403_0
(PROTON-GATED ION
CHANNEL)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
3 / 3 ARG A 911
TYR A1048
GLU A 882
None
0.65A 4zzbE-3zhrA:
undetectable
4zzbE-3zhrA:
17.08
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.
5B1A_P_CHDP305_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.96A 5b1aP-3zhrA:
undetectable
5b1aW-3zhrA:
undetectable
5b1aP-3zhrA:
14.22
5b1aW-3zhrA:
6.02
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.
5B3S_C_CHDC307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.95A 5b3sC-3zhrA:
undetectable
5b3sJ-3zhrA:
undetectable
5b3sC-3zhrA:
14.22
5b3sJ-3zhrA:
6.02
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.
5B3S_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.97A 5b3sP-3zhrA:
undetectable
5b3sP-3zhrA:
14.22
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.
5DBY_A_ACTA612_0
(SERUM ALBUMIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 4 SER A1022
HIS A1013
GLU A1170
PRO A1171
None
1.28A 5dbyA-3zhrA:
0.8
5dbyA-3zhrA:
22.05
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.
5VEU_H_RITH602_1
(CYTOCHROME P450 3A5)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
5 / 12 LEU A 972
GLY A 893
ALA A 913
THR A 925
GLY A 941
None
1.02A 5veuH-3zhrA:
undetectable
5veuH-3zhrA:
21.15
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.
5X23_A_LSNA502_2
(CYTOCHROME P450 2C9)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
3 / 3 LEU A 530
VAL A 725
ASP A 726
None
0.60A 5x23A-3zhrA:
undetectable
5x23A-3zhrA:
18.48
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.
5X7P_A_ACRA1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 6 SER A 963
ARG A 897
GLU A 959
TYR A 962
None
1.49A 5x7pA-3zhrA:
undetectable
5x7pA-3zhrA:
21.48
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.
5X7P_B_ACRB1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 6 SER A 963
ARG A 897
GLU A 959
TYR A 962
None
1.46A 5x7pB-3zhrA:
undetectable
5x7pB-3zhrA:
21.48
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.
5XDH_C_DAHC60_1
(PUTATIVE CYTOCHROME
C)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 6 GLN A 985
HIS A1011
ASN A 982
LEU A1029
None
1.26A 5xdhA-3zhrA:
undetectable
5xdhC-3zhrA:
undetectable
5xdhA-3zhrA:
7.85
5xdhC-3zhrA:
7.85
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.
5ZCQ_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 7 LEU A1146
GLN A1142
PHE A1180
LEU A1184
None
MPD  A2228 (-3.2A)
None
None
0.96A 5zcqC-3zhrA:
undetectable
5zcqJ-3zhrA:
undetectable
5zcqC-3zhrA:
14.22
5zcqJ-3zhrA:
6.02
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.
5ZV2_A_LEVA801_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
3 / 3 LYS A 894
LEU A 972
ASP A1004
None
None
CA  A2003 (-2.1A)
0.92A 5zv2A-3zhrA:
undetectable
5zv2A-3zhrA:
7.27
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.
6DWD_D_GLYD713_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
3 / 3 ARG A 911
HIS A 912
ARG A 867
None
0.79A 6dwdD-3zhrA:
undetectable
6dwdD-3zhrA:
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.
6MVX_A_K4DA1304_0
(ION TRANSPORT
PROTEIN)
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacteriu
m
smegmatis)
4 / 6 MET A 641
LEU A 640
THR A 668
LEU A 530
None
1.15A 6mvxA-3zhrA:
1.9
6mvxB-3zhrA:
2.4
6mvxC-3zhrA:
2.3
6mvxA-3zhrA:
16.02
6mvxB-3zhrA:
16.02
6mvxC-3zhrA:
16.02