SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1pk0'

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.
1J3J_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		5 / 9 ASP A 491
ASN A 387
SER A 390
ILE A 398
ILE A 364
 YB  A 901 (-2.5A)
None
None
None
None
 1.44A 1j3jB-1pk0A:
undetectable		 1j3jB-1pk0A:
22.95
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.
1LQT_A_ACTA1872_0
(FPRA)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 5 SER A 354
ASN A 332
ALA A 335
ASP A 356
 EMA  A1999 (-3.0A)
None
None
None
 1.18A 1lqtA-1pk0A:
undetectable
1lqtB-1pk0A:
undetectable		 1lqtA-1pk0A:
21.20
1lqtB-1pk0A:
21.20
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.
1LQU_A_ACTA1429_0
(FPRA)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 5 SER A 354
ASN A 332
ALA A 335
ASP A 356
 EMA  A1999 (-3.0A)
None
None
None
 1.20A 1lquA-1pk0A:
undetectable
1lquB-1pk0A:
undetectable		 1lquA-1pk0A:
21.20
1lquB-1pk0A:
21.20
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.
2A15_A_NCAA1001_0
(HYPOTHETICAL PROTEIN
RV0760C)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		5 / 11 SER A 355
ILE A 418
LEU A 413
LEU A 403
LEU A 405
 None
 1.21A 2a15A-1pk0A:
undetectable		 2a15A-1pk0A:
13.51
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.
2HJH_A_NCAA900_0
(NAD-DEPENDENT
HISTONE DEACETYLASE
SIR2)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 5 ILE A 364
PRO A 365
PHE A 366
ILE A 398
 None
 1.07A 2hjhA-1pk0A:
undetectable		 2hjhA-1pk0A:
21.61
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.
2VXA_A_RBFA200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 TYR A 632
ARG A 630
ARG A 540
GLN A 553
 None
 1.43A 2vxaA-1pk0A:
0.0
2vxaC-1pk0A:
0.0
2vxaE-1pk0A:
0.0		 2vxaA-1pk0A:
10.38
2vxaC-1pk0A:
10.38
2vxaE-1pk0A:
10.38
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.
2VXA_B_RBFB200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 ARG A 630
TYR A 632
ARG A 540
GLN A 553
 None
 1.39A 2vxaA-1pk0A:
0.0
2vxaB-1pk0A:
0.0
2vxaK-1pk0A:
0.0		 2vxaA-1pk0A:
10.38
2vxaB-1pk0A:
10.38
2vxaK-1pk0A:
10.38
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.
2VXA_C_RBFC200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 ARG A 630
TYR A 632
ARG A 540
GLN A 553
 None
 1.44A 2vxaB-1pk0A:
0.0
2vxaC-1pk0A:
0.0
2vxaG-1pk0A:
0.0		 2vxaB-1pk0A:
10.38
2vxaC-1pk0A:
10.38
2vxaG-1pk0A:
10.38
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.
2VXA_D_RBFD200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 TYR A 632
ARG A 630
ARG A 540
GLN A 553
 None
 1.42A 2vxaD-1pk0A:
0.0
2vxaF-1pk0A:
0.0
2vxaI-1pk0A:
0.0		 2vxaD-1pk0A:
10.38
2vxaF-1pk0A:
10.38
2vxaI-1pk0A:
10.38
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.
2VXA_E_RBFE200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 ARG A 630
TYR A 632
ARG A 540
GLN A 553
 None
 1.42A 2vxaD-1pk0A:
0.0
2vxaE-1pk0A:
0.0
2vxaL-1pk0A:
0.0		 2vxaD-1pk0A:
10.38
2vxaE-1pk0A:
10.38
2vxaL-1pk0A:
10.38
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.
2VXA_H_RBFH200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 ARG A 540
GLN A 553
ARG A 630
TYR A 632
 None
 1.42A 2vxaB-1pk0A:
0.0
2vxaG-1pk0A:
0.0
2vxaH-1pk0A:
0.0		 2vxaB-1pk0A:
10.38
2vxaG-1pk0A:
10.38
2vxaH-1pk0A:
10.38
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.
2VXA_I_RBFI200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 ARG A 630
TYR A 632
ARG A 540
GLN A 553
 None
 1.41A 2vxaH-1pk0A:
0.0
2vxaI-1pk0A:
0.0
2vxaJ-1pk0A:
undetectable		 2vxaH-1pk0A:
10.38
2vxaI-1pk0A:
10.38
2vxaJ-1pk0A:
10.38
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.
2VXA_J_RBFJ200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 ARG A 540
GLN A 553
TYR A 632
ARG A 630
 None
 1.40A 2vxaD-1pk0A:
0.0
2vxaJ-1pk0A:
undetectable
2vxaL-1pk0A:
0.0		 2vxaD-1pk0A:
10.38
2vxaJ-1pk0A:
10.38
2vxaL-1pk0A:
10.38
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.
2VXA_K_RBFK200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 ARG A 540
GLN A 553
ARG A 630
TYR A 632
 None
 1.45A 2vxaH-1pk0A:
undetectable
2vxaJ-1pk0A:
undetectable
2vxaK-1pk0A:
undetectable		 2vxaH-1pk0A:
10.38
2vxaJ-1pk0A:
10.38
2vxaK-1pk0A:
10.38
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.
2VXA_L_RBFL200_1
(DODECIN)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 8 ARG A 540
GLN A 553
ARG A 630
TYR A 632
 None
 1.47A 2vxaA-1pk0A:
undetectable
2vxaK-1pk0A:
undetectable
2vxaL-1pk0A:
undetectable		 2vxaA-1pk0A:
10.38
2vxaK-1pk0A:
10.38
2vxaL-1pk0A:
10.38
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.
2XKK_E_MFXE1100_1
(TOPOISOMERASE IV
DNA)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		3 / 3 ARG A 672
GLU A 662
SER A 673
 None
 0.89A 2xkkA-1pk0A:
2.7
2xkkC-1pk0A:
3.5		 2xkkA-1pk0A:
22.09
2xkkC-1pk0A:
22.09
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.
3BRF_A_SORA2_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		3 / 3 LYS A 297
LYS A 292
VAL A 295
 None
 1.04A 3brfA-1pk0A:
undetectable		 3brfA-1pk0A:
21.58
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.
3DLC_A_SAMA220_0
(PUTATIVE
S-ADENOSYL-L-METHION
INE-DEPENDENT
METHYLTRANSFERASE)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		5 / 12 GLY A 578
GLY A 547
ASP A 491
VAL A 575
ARG A 540
 EMA  A1999 (-3.4A)
EMA  A1999 (-3.4A)
YB  A 901 (-2.5A)
None
None
 1.34A 3dlcA-1pk0A:
undetectable		 3dlcA-1pk0A:
19.17
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.
3P6H_A_IBPA133_1
(FATTY ACID-BINDING
PROTEIN, ADIPOCYTE)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 7 PHE A 469
ASP A 369
ILE A 474
ARG A 472
 None
 1.08A 3p6hA-1pk0A:
undetectable		 3p6hA-1pk0A:
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.
4EJW_A_SRYA2001_2
(TRANSCRIPTIONAL
REGULATOR TCAR)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 6 GLU A 397
ILE A 398
ASN A 349
VAL A 343
 None
 1.11A 4ejwB-1pk0A:
0.0		 4ejwB-1pk0A:
17.56
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.
4NQA_A_9CRA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		5 / 11 ALA A 319
LEU A 497
ALA A 498
VAL A 574
HIS A 311
 None
 1.15A 4nqaA-1pk0A:
undetectable		 4nqaA-1pk0A:
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.
4W5T_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 6 ARG A 755
ILE A 756
GLN A 759
ILE A 654
 None
 1.02A 4w5tA-1pk0A:
undetectable		 4w5tA-1pk0A:
19.56
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.
4Z4C_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 6 ARG A 755
ILE A 756
GLN A 759
ILE A 654
 None
 1.14A 4z4cA-1pk0A:
undetectable		 4z4cA-1pk0A:
19.56
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.
4Z4D_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 6 ARG A 755
ILE A 756
GLN A 759
ILE A 654
 None
 1.22A 4z4dA-1pk0A:
0.0		 4z4dA-1pk0A:
19.56
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.
5AJQ_B_DB8B800_1
(SERINE/THREONINE-PRO
TEIN KINASE 10)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		5 / 10 ILE A 596
GLY A 306
LEU A 307
ALA A 312
ASP A 313
 None
 1.33A 5ajqB-1pk0A:
undetectable		 5ajqB-1pk0A:
23.29
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.
5D75_A_FK5A301_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP3)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		5 / 11 TYR A 492
ILE A 596
ALA A 563
ILE A 318
PHE A 328
 None
 1.17A 5d75A-1pk0A:
undetectable		 5d75A-1pk0A:
12.98
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.
5DSG_B_0HKB1201_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		3 / 3 ASP A 590
ASN A 607
PHE A 614
 None
 0.72A 5dsgB-1pk0A:
0.2		 5dsgB-1pk0A:
20.15
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.
5YW0_A_ACTA412_0
(UNCHARACTERIZED
PROTEIN KDOO)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		3 / 3 LYS A 404
ASN A 451
SER A 447
 None
 1.10A 5yw0A-1pk0A:
undetectable		 5yw0A-1pk0A:
20.90
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.
6CBD_A_TRPA903_0
(PROTEIN ARGONAUTE-2)		 1pk0 CALMODULIN-SENSITIVE
ADENYLATE CYCLASE
(Bacillus
anthracis) 		4 / 6 ARG A 755
ILE A 756
GLN A 759
ILE A 654
 None
 1.15A 6cbdA-1pk0A:
undetectable		 6cbdA-1pk0A:
19.56