SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1khu'

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.
1MNV_D_DVAD8_0
(ACTINOMYCIN D)
1khu SMAD1
(Homo
sapiens)
3 / 3 THR A 369
THR A 370
PRO A 368
None
0.84A 1mnvD-1khuA:
undetectable
1mnvD-1khuA:
9.28
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.
1NBH_A_SAMA293_0
(GLYCINE
N-METHYLTRANSFERASE)
1khu SMAD1
(Homo
sapiens)
5 / 12 ILE A 436
GLY A 333
VAL A 296
SER A 351
TYR A 276
None
1.34A 1nbhA-1khuA:
undetectable
1nbhA-1khuA:
19.29
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.
1NBH_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)
1khu SMAD1
(Homo
sapiens)
5 / 12 ILE A 436
GLY A 333
VAL A 296
SER A 351
TYR A 276
None
1.34A 1nbhC-1khuA:
undetectable
1nbhC-1khuA:
19.29
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.
1NBH_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)
1khu SMAD1
(Homo
sapiens)
5 / 12 ILE A 436
GLY A 333
VAL A 296
SER A 351
TYR A 276
None
1.35A 1nbhD-1khuA:
undetectable
1nbhD-1khuA:
19.29
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.
3BPX_A_SALA257_1
(TRANSCRIPTIONAL
REGULATOR)
1khu SMAD1
(Homo
sapiens)
4 / 8 CYH A 434
THR A 322
ILE A 323
THR A 326
None
0.93A 3bpxA-1khuA:
0.0
3bpxB-1khuA:
0.0
3bpxA-1khuA:
20.83
3bpxB-1khuA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KP6_B_SALB3001_1
(TRANSCRIPTIONAL
REGULATOR TCAR)
1khu SMAD1
(Homo
sapiens)
4 / 8 GLU A 387
ASN A 385
ASN A 359
ILE A 382
None
1.20A 3kp6A-1khuA:
undetectable
3kp6B-1khuA:
0.0
3kp6A-1khuA:
18.58
3kp6B-1khuA:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U9F_E_CLME221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
1khu SMAD1
(Homo
sapiens)
3 / 3 PHE A 366
CYH A 360
HIS A 364
None
1.26A 3u9fF-1khuA:
0.0
3u9fF-1khuA:
19.07
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.
3U9F_K_CLMK221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
1khu SMAD1
(Homo
sapiens)
3 / 3 PHE A 366
CYH A 360
HIS A 364
None
1.29A 3u9fL-1khuA:
0.0
3u9fL-1khuA:
19.07
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.
3U9F_R_CLMR221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
1khu SMAD1
(Homo
sapiens)
3 / 3 PHE A 366
CYH A 360
HIS A 364
None
1.15A 3u9fS-1khuA:
0.0
3u9fS-1khuA:
19.07
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.
4ZZB_E_ACTE403_0
(PROTON-GATED ION
CHANNEL)
1khu SMAD1
(Homo
sapiens)
3 / 3 ARG A 319
TYR A 276
GLU A 278
None
0.58A 4zzbE-1khuA:
undetectable
4zzbE-1khuA:
21.12
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.
5NUM_A_Z80A201_1
(BETA-LACTOGLOBULIN)
1khu SMAD1
(Homo
sapiens)
5 / 8 VAL A 294
ILE A 274
ILE A 438
ILE A 412
SER A 379
None
1.32A 5numA-1khuA:
undetectable
5numA-1khuA:
17.89
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.
5NWV_A_ACAA18_1
(SCRFP-TAG,GP41)
1khu SMAD1
(Homo
sapiens)
5 / 12 LEU A 440
GLY A 442
ASN A 385
GLU A 387
LEU A 392
None
1.09A 5nwvA-1khuA:
0.0
5nwvA-1khuA:
12.38