SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2g5t'

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.
1DY4_A_SNPA437_2
(EXOGLUCANASE 1)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 5 HIS A 748
TRP A 627
ALA A 654
TRP A 629
None
1.44A 1dy4A-2g5tA:
undetectable
1dy4A-2g5tA:
20.11
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.
1HSH_A_MK1A401_1
(HIV-II PROTEASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 ASP A 136
ILE A 143
ILE A 176
ILE A 148
ILE A 134
None
0.72A 1hshA-2g5tA:
undetectable
1hshA-2g5tA:
9.98
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)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 604
GLY A 641
PHE A 695
LEU A 723
PHE A 647
None
0.91A 1nw3A-2g5tA:
undetectable
1nw3A-2g5tA:
18.68
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.
1W5U_D_DVAD8_0
(GRAMICIDIN D)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 VAL A 656
VAL A 688
TRP A 659
None
0.94A 1w5uC-2g5tA:
undetectable
1w5uD-2g5tA:
undetectable
1w5uC-2g5tA:
3.81
1w5uD-2g5tA:
3.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1X70_A_715A801_1
(DIPEPTIDYL PEPTIDASE
IV)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
12 / 12 ARG A 125
GLU A 205
GLU A 206
SER A 209
PHE A 357
TYR A 547
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
None
None
ACF  A 800 (-4.5A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.26A 1x70A-2g5tA:
58.6
1x70A-2g5tA:
99.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1X70_A_715A801_2
(DIPEPTIDYL PEPTIDASE
IV)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 358
SER A 630
TYR A 631
None
ACF  A 800 (-1.3A)
None
0.76A 1x70A-2g5tA:
58.6
1x70A-2g5tA:
99.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1X70_B_715B801_1
(DIPEPTIDYL PEPTIDASE
IV)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
12 / 12 ARG A 125
GLU A 205
GLU A 206
SER A 209
ARG A 358
SER A 630
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
None
None
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.32A 1x70B-2g5tA:
57.8
1x70B-2g5tA:
99.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1X70_B_715B801_2
(DIPEPTIDYL PEPTIDASE
IV)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 PHE A 357
TYR A 547
TYR A 631
None
ACF  A 800 (-4.5A)
None
0.18A 1x70B-2g5tA:
57.8
1x70B-2g5tA:
99.86
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.
2B8J_A_SPMA653_1
(CLASS B ACID
PHOSPHATASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 9 LYS A 760
GLY A 628
ASP A 545
THR A 753
TYR A 752
None
1.42A 2b8jA-2g5tA:
0.6
2b8jA-2g5tA:
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.
2BXE_A_1FLA2002_1
(SERUM ALBUMIN)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 10 ALA A 576
LEU A 544
LEU A 542
ALA A 610
VAL A 619
None
1.15A 2bxeA-2g5tA:
undetectable
2bxeA-2g5tA:
20.56
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.
2IZQ_A_DVAA8_0
(GRAMICIDIN D)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 VAL A 688
TRP A 659
VAL A 656
None
0.96A 2izqA-2g5tA:
undetectable
2izqB-2g5tA:
undetectable
2izqA-2g5tA:
3.81
2izqB-2g5tA:
3.81
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.
2J2P_B_SC2B1290_1
(FICOLIN-2)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 8 LEU A 410
SER A 412
LEU A 436
ASP A 413
None
1.09A 2j2pA-2g5tA:
undetectable
2j2pB-2g5tA:
undetectable
2j2pA-2g5tA:
15.05
2j2pB-2g5tA:
15.05
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.
2NMZ_B_ROCB401_2
(PROTEASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 184
VAL A 155
THR A 152
None
0.75A 2nmzA-2g5tA:
undetectable
2nmzA-2g5tA:
10.00
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.
2NNK_A_ROCA401_2
(PROTEASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 184
VAL A 155
THR A 152
None
0.75A 2nnkA-2g5tA:
undetectable
2nnkA-2g5tA:
10.14
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.
2PGR_A_DCFA501_2
(ADENOSINE DEAMINASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 LEU A 561
LEU A  57
PHE A 559
None
0.70A 2pgrA-2g5tA:
undetectable
2pgrA-2g5tA:
18.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2RGU_A_356A901_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 GLU A 205
GLU A 206
PHE A 357
TRP A 629
SER A 630
TYR A 631
VAL A 656
TYR A 662
TYR A 666
VAL A 711
HIS A 740
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
None
None
ACF  A 800 (-1.3A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
0.25A 2rguA-2g5tA:
57.7
2rguA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2RGU_A_356A901_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 GLU A 205
GLU A 206
PHE A 357
TYR A 547
TRP A 629
SER A 630
TYR A 631
VAL A 656
TYR A 662
TYR A 666
HIS A 740
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
None
ACF  A 800 (-4.5A)
None
ACF  A 800 (-1.3A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
0.49A 2rguA-2g5tA:
57.7
2rguA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2RGU_A_356A901_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 206
SER A 630
VAL A 656
TYR A 662
VAL A 711
ACF  A 800 (-3.2A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
None
1.24A 2rguA-2g5tA:
57.7
2rguA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2RGU_A_356A901_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 206
TYR A 547
SER A 630
VAL A 656
TYR A 662
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
1.35A 2rguA-2g5tA:
57.7
2rguA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2RGU_B_356B902_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 11 GLU A 205
GLU A 206
TYR A 547
TRP A 629
SER A 630
TYR A 631
VAL A 656
TYR A 662
TYR A 666
VAL A 711
HIS A 740
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
None
ACF  A 800 (-1.3A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
0.47A 2rguB-2g5tA:
57.3
2rguB-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2RGU_B_356B902_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 11 TRP A 629
TYR A 634
TYR A 662
VAL A 711
HIS A 740
None
None
ACF  A 800 (-4.1A)
None
None
1.11A 2rguB-2g5tA:
57.3
2rguB-2g5tA:
100.00
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.
2Y7K_B_SALB1305_1
(LYSR-TYPE REGULATORY
PROTEIN)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 5 SER A 349
PRO A 359
GLY A 355
TRP A 353
None
1.20A 2y7kB-2g5tA:
undetectable
2y7kB-2g5tA:
13.95
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.
2Y7P_A_SALA1001_1
(LYSR-TYPE REGULATORY
PROTEIN)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 6 SER A 349
PRO A 359
GLY A 355
TRP A 353
None
1.15A 2y7pA-2g5tA:
undetectable
2y7pA-2g5tA:
13.95
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.
3ARR_A_PNXA606_1
(CHITINASE A)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 7 GLY A 335
ASP A 329
TYR A 330
ARG A 310
None
1.12A 3arrA-2g5tA:
undetectable
3arrA-2g5tA:
21.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BJM_A_BJMA1_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
12 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
SER A 630
TYR A 631
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.24A 3bjmA-2g5tA:
57.9
3bjmA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BJM_A_BJMA1_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 TYR A 634
TYR A 662
ASN A 710
VAL A 711
HIS A 740
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
1.07A 3bjmA-2g5tA:
57.9
3bjmA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BJM_B_BJMB2_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
12 / 12 ARG A 125
GLU A 205
GLU A 206
PHE A 357
TYR A 547
SER A 630
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
None
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.30A 3bjmB-2g5tA:
57.8
3bjmB-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BJM_B_BJMB2_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
7 / 12 GLU A 205
PHE A 357
TYR A 547
SER A 630
VAL A 656
TYR A 662
VAL A 711
ACF  A 800 (-3.6A)
None
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
None
1.34A 3bjmB-2g5tA:
57.8
3bjmB-2g5tA:
100.00
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.
3BXO_A_SAMA238_1
(N,N-DIMETHYLTRANSFER
ASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 TYR A 670
GLU A 205
ASP A 739
None
ACF  A 800 (-3.6A)
None
0.74A 3bxoA-2g5tA:
undetectable
3bxoA-2g5tA:
15.49
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.
3BXO_B_SAMB238_1
(N,N-DIMETHYLTRANSFER
ASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 TYR A 670
GLU A 205
ASP A 739
None
ACF  A 800 (-3.6A)
None
0.81A 3bxoB-2g5tA:
undetectable
3bxoB-2g5tA:
15.49
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.
3CZH_A_D2VA602_1
(CYTOCHROME P450 2R1)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 VAL A 546
ALA A 548
ALA A 555
ILE A 607
THR A 636
None
1.12A 3czhA-2g5tA:
undetectable
3czhA-2g5tA:
20.76
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.
3DL9_B_V2HB602_0
(CYTOCHROME P450 2R1)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 VAL A 546
ALA A 548
ALA A 555
ILE A 607
THR A 636
None
1.12A 3dl9B-2g5tA:
undetectable
3dl9B-2g5tA:
20.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_A_T22A800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
SER A 630
TYR A 631
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.64A 3g0bA-2g5tA:
54.6
3g0bA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_A_T22A800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
TYR A 631
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.47A 3g0bA-2g5tA:
54.6
3g0bA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_A_T22A800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 205
TYR A 547
SER A 630
TYR A 662
VAL A 711
ACF  A 800 (-3.6A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
ACF  A 800 (-4.1A)
None
1.39A 3g0bA-2g5tA:
54.6
3g0bA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_A_T22A800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
6 / 12 SER A 630
TYR A 634
TYR A 662
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
1.28A 3g0bA-2g5tA:
54.6
3g0bA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_B_T22B800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
SER A 630
TYR A 631
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.65A 3g0bB-2g5tA:
54.1
3g0bB-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_B_T22B800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
TYR A 631
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.48A 3g0bB-2g5tA:
54.1
3g0bB-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_B_T22B800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 205
TYR A 547
SER A 630
TYR A 662
VAL A 711
ACF  A 800 (-3.6A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
ACF  A 800 (-4.1A)
None
1.36A 3g0bB-2g5tA:
54.1
3g0bB-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_B_T22B800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 206
TYR A 547
VAL A 656
TYR A 662
VAL A 711
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
None
ACF  A 800 (-4.1A)
None
1.40A 3g0bB-2g5tA:
54.1
3g0bB-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_B_T22B800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
6 / 12 SER A 630
TYR A 634
TYR A 662
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
1.30A 3g0bB-2g5tA:
54.1
3g0bB-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_C_T22C800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
SER A 630
TYR A 631
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.68A 3g0bC-2g5tA:
54.0
3g0bC-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_C_T22C800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
TYR A 631
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.49A 3g0bC-2g5tA:
54.0
3g0bC-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_C_T22C800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 205
TYR A 547
SER A 630
TYR A 662
VAL A 711
ACF  A 800 (-3.6A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
ACF  A 800 (-4.1A)
None
1.37A 3g0bC-2g5tA:
54.0
3g0bC-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_C_T22C800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 205
TYR A 547
VAL A 656
TYR A 662
VAL A 711
ACF  A 800 (-3.6A)
ACF  A 800 (-4.5A)
None
ACF  A 800 (-4.1A)
None
1.23A 3g0bC-2g5tA:
54.0
3g0bC-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_C_T22C800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
6 / 12 SER A 630
TYR A 634
TYR A 662
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
1.31A 3g0bC-2g5tA:
54.0
3g0bC-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_D_T22D800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
SER A 630
TYR A 631
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.66A 3g0bD-2g5tA:
56.5
3g0bD-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_D_T22D800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
TYR A 631
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.49A 3g0bD-2g5tA:
56.5
3g0bD-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_D_T22D800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 GLU A 205
TYR A 547
SER A 630
TYR A 662
VAL A 711
ACF  A 800 (-3.6A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
ACF  A 800 (-4.1A)
None
1.34A 3g0bD-2g5tA:
56.5
3g0bD-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G0B_D_T22D800_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
6 / 12 SER A 630
TYR A 634
TYR A 662
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
1.30A 3g0bD-2g5tA:
56.5
3g0bD-2g5tA:
100.00
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.
3K4V_B_ROCB201_2
(HIV-1 PROTEASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 184
VAL A 155
THR A 152
None
0.80A 3k4vA-2g5tA:
undetectable
3k4vA-2g5tA:
10.42
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.
3K4V_D_ROCD201_4
(HIV-1 PROTEASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 184
VAL A 155
THR A 152
None
0.76A 3k4vD-2g5tA:
undetectable
3k4vD-2g5tA:
10.00
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.
3L8L_D_DVAD8_0
(GRAMICIDIN D)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 VAL A 656
VAL A 688
TRP A 659
None
0.90A 3l8lC-2g5tA:
undetectable
3l8lD-2g5tA:
undetectable
3l8lC-2g5tA:
3.81
3l8lD-2g5tA:
3.81
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.
3NAI_A_URFA521_1
(RNA DEPENDENT RNA
POLYMERASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 5 ARG A 125
ASP A 709
ASP A 739
ASP A 708
ACF  A 800 (-3.4A)
None
None
None
1.45A 3naiA-2g5tA:
0.0
3naiA-2g5tA:
22.02
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.
3NDU_D_ROCD100_3
(PROTEASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 184
VAL A 155
THR A 152
None
0.75A 3nduD-2g5tA:
undetectable
3nduD-2g5tA:
10.42
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.
3PWR_A_ROCA401_2
(PROTEASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 184
VAL A 155
THR A 152
None
0.77A 3pwrA-2g5tA:
undetectable
3pwrA-2g5tA:
9.86
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.
3SJ0_X_DXCX75_0
(CYTOCHROME C7)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 7 ILE A 518
MET A 425
LYS A 423
GLY A 424
None
1.21A 3sj0X-2g5tA:
undetectable
3sj0X-2g5tA:
7.33
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.
3TL9_A_ROCA401_2
(PROTEASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 184
VAL A 155
THR A 152
None
0.76A 3tl9A-2g5tA:
undetectable
3tl9A-2g5tA:
10.97
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.
3TOP_A_ACRA1_2
(MALTASE-GLUCOAMYLASE
, INTESTINAL)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 5 ILE A 703
TRP A 627
TRP A 563
THR A  46
None
1.40A 3topA-2g5tA:
0.1
3topA-2g5tA:
21.41
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.
3V35_A_NTIA317_1
(ALDOSE REDUCTASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 8 TRP A 315
VAL A 303
TRP A 215
PHE A 208
None
1.34A 3v35A-2g5tA:
undetectable
3v35A-2g5tA:
18.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3W2T_A_LF7A801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
12 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
SER A 630
TYR A 631
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.22A 3w2tA-2g5tA:
57.7
3w2tA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3W2T_A_LF7A801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
6 / 12 SER A 630
TYR A 634
TYR A 662
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
1.28A 3w2tA-2g5tA:
57.7
3w2tA-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3W2T_B_LF7B801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
12 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
SER A 630
TYR A 631
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.21A 3w2tB-2g5tA:
58.1
3w2tB-2g5tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3W2T_B_LF7B801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
6 / 12 SER A 630
TYR A 634
TYR A 662
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
1.28A 3w2tB-2g5tA:
58.1
3w2tB-2g5tA:
100.00
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.
4B53_B_ACTB1445_0
(IG GAMMA-4 CHAIN C
REGION)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 GLU A 347
GLY A 355
SER A 323
None
0.59A 4b53B-2g5tA:
undetectable
4b53B-2g5tA:
11.85
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.
4F5Z_A_BEZA302_0
(HALOALKANE
DEHALOGENASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 8 ASN A 710
ASP A 708
VAL A 656
HIS A 704
ACF  A 800 (-3.3A)
None
None
None
1.22A 4f5zA-2g5tA:
12.7
4f5zA-2g5tA:
17.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FFW_A_715A801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
ARG A 358
TYR A 547
SER A 630
VAL A 656
TYR A 662
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
None
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
0.36A 4ffwA-2g5tA:
53.1
4ffwA-2g5tA:
84.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FFW_A_715A801_2
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 PHE A 357
TYR A 631
TYR A 666
None
None
ACF  A 800 (-3.3A)
0.26A 4ffwA-2g5tA:
53.1
4ffwA-2g5tA:
84.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FFW_B_715B801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
11 / 12 ARG A 125
GLU A 205
GLU A 206
PHE A 357
TYR A 547
SER A 630
VAL A 656
TYR A 662
TYR A 666
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
None
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
0.39A 4ffwB-2g5tA:
51.6
4ffwB-2g5tA:
84.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FFW_B_715B801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
7 / 12 GLU A 205
PHE A 357
TYR A 547
SER A 630
VAL A 656
TYR A 662
VAL A 711
ACF  A 800 (-3.6A)
None
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
None
1.29A 4ffwB-2g5tA:
51.6
4ffwB-2g5tA:
84.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FFW_B_715B801_2
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 358
TYR A 631
ASN A 710
None
None
ACF  A 800 (-3.3A)
0.48A 4ffwB-2g5tA:
51.6
4ffwB-2g5tA:
84.50
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)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 MET A 325
GLN A 320
TYR A 299
None
0.72A 4udcA-2g5tA:
undetectable
4udcA-2g5tA:
17.77
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.
4UIN_H_QI9H1226_0
(FAB 314.3)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 HIS A 592
THR A 351
GLY A 355
ARG A 356
GLY A 584
None
1.29A 4uinH-2g5tA:
undetectable
4uinL-2g5tA:
undetectable
4uinH-2g5tA:
16.05
4uinL-2g5tA:
13.79
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.
4W5Q_A_IPHA903_0
(PROTEIN ARGONAUTE-2)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 5 TYR A 132
PRO A 149
LEU A 164
TYR A 166
None
1.31A 4w5qA-2g5tA:
0.4
4w5qA-2g5tA:
22.89
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.
4Z4C_A_IPHA904_0
(PROTEIN ARGONAUTE-2)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 6 TYR A 132
PRO A 149
LEU A 164
TYR A 166
None
1.30A 4z4cA-2g5tA:
3.1
4z4cA-2g5tA:
22.89
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.
5FVO_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 184
VAL A 167
TRP A 168
None
1.26A 5fvoA-2g5tA:
1.0
5fvoA-2g5tA:
18.96
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.
5GWX_A_SAMA301_1
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 ARG A 492
ASN A  80
ASP A  65
None
0.91A 5gwxA-2g5tA:
undetectable
5gwxA-2g5tA:
17.58
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.
5MZR_E_PFLE409_1
(PROTON-GATED ION
CHANNEL)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 8 ILE A 374
VAL A 404
THR A 398
ILE A 397
None
0.83A 5mzrE-2g5tA:
undetectable
5mzrE-2g5tA:
9.76
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.
5N4T_A_BEZA507_0
(BETA-LACTAMASE VIM-2)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 THR A 600
HIS A 682
ASN A 685
None
0.92A 5n4tA-2g5tA:
1.6
5n4tA-2g5tA:
15.47
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.
5U63_A_ACTA406_0
(THIOREDOXIN
REDUCTASE)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
3 / 3 HIS A 100
SER A 131
ARG A 147
None
1.02A 5u63A-2g5tA:
undetectable
5u63A-2g5tA:
17.86
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.
5VCE_A_RITA602_1
(CYTOCHROME P450 3A4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 ILE A 703
ALA A 652
THR A 636
ILE A 626
ALA A 625
None
0.89A 5vceA-2g5tA:
undetectable
5vceA-2g5tA:
21.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6B1E_B_LF7B801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
12 / 12 ARG A 125
GLU A 205
GLU A 206
TYR A 547
SER A 630
TYR A 631
VAL A 656
TYR A 662
TYR A 666
ASN A 710
VAL A 711
HIS A 740
ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
ACF  A 800 (-3.3A)
None
None
0.22A 6b1eB-2g5tA:
58.3
6b1eB-2g5tA:
99.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6B1E_B_LF7B801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
6 / 12 GLU A 206
TYR A 547
SER A 630
VAL A 656
TYR A 662
VAL A 711
ACF  A 800 (-3.2A)
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
None
1.13A 6b1eB-2g5tA:
58.3
6b1eB-2g5tA:
99.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6B1E_B_LF7B801_1
(DIPEPTIDYL PEPTIDASE
4)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
5 / 12 TYR A 634
TYR A 662
ASN A 710
VAL A 711
HIS A 740
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
1.11A 6b1eB-2g5tA:
58.3
6b1eB-2g5tA:
99.86
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.
6DHB_A_BEZA202_0
(HEPATITIS A VIRUS
CELLULAR RECEPTOR 2)
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo
sapiens)
4 / 6 ARG A 184
ILE A 194
ASN A 196
ASP A 171
None
1.46A 6dhbA-2g5tA:
undetectable
6dhbA-2g5tA:
8.86