SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ffs'

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.
1AEG_A_4APA296_1
(CYTOCHROME C
PEROXIDASE)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 8 GLY A  67
GLY A  61
MET A  58
LEU A 278
 None
 0.86A 1aegA-3ffsA:
undetectable		 1aegA-3ffsA:
19.55
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.
1IEP_A_STIA201_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 6 LYS A 180
VAL A 161
VAL A 153
ILE A 179
 None
 1.02A 1iepA-3ffsA:
undetectable		 1iepA-3ffsA:
24.10
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.
1RG9_A_SAMA385_1
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 8 ALA A 155
ASP A 186
ILE A 185
ILE A 179
 None
 0.88A 1rg9B-3ffsA:
undetectable		 1rg9B-3ffsA:
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.
1SDT_B_MK1B902_2
(PROTEASE RETROPEPSIN)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		5 / 12 GLY A 205
ALA A 206
ASP A 207
ILE A 188
VAL A 192
 None
 0.99A 1sdtB-3ffsA:
undetectable		 1sdtB-3ffsA:
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.
2BU8_A_TF4A1379_1
(PYRUVATE
DEHYDROGENASE KINASE
ISOENZYME 2)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 8 LEU A  45
ILE A 261
ILE A 274
ILE A 255
 None
 0.85A 2bu8A-3ffsA:
undetectable		 2bu8A-3ffsA:
21.51
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.
2DTJ_B_THRB402_0
(ASPARTOKINASE)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		5 / 9 ILE A 255
ILE A 232
GLY A 262
ALA A 264
THR A  11
 None
 1.06A 2dtjA-3ffsA:
undetectable
2dtjB-3ffsA:
undetectable		 2dtjA-3ffsA:
18.81
2dtjB-3ffsA:
18.81
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.
3BJW_E_SVRE503_1
(PHOSPHOLIPASE A2)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		5 / 11 VAL A 272
LEU A  45
ILE A  68
SER A  40
THR A  33
 None
 1.36A 3bjwE-3ffsA:
undetectable		 3bjwE-3ffsA:
16.04
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.
3MSS_C_STIC1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 6 LYS A 180
VAL A 161
VAL A 153
ILE A 179
 None
 1.01A 3mssC-3ffsA:
undetectable		 3mssC-3ffsA:
24.10
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.
3PYY_A_STIA3_2
(V-ABL ABELSON MURINE
LEUKEMIA VIRAL
ONCOGENE HOMOLOG 1
ISOFORM B VARIANT)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 6 LYS A 180
VAL A 161
VAL A 153
ILE A 179
 None
 1.11A 3pyyA-3ffsA:
undetectable		 3pyyA-3ffsA:
24.45
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.
4C8B_A_0LIA1000_2
(RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 5 VAL A 161
ILE A 255
MET A  50
ILE A 274
 None
 0.94A 4c8bA-3ffsA:
undetectable		 4c8bA-3ffsA:
23.73
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.
4D39_B_MTLB870_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 7 ASN A 184
ILE A 185
ASN A  38
ASP A 207
 None
 1.11A 4d39B-3ffsA:
undetectable		 4d39B-3ffsA:
19.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FXS_A_MOAA702_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		5 / 9 ASP A 163
SER A 164
ASN A 191
ILE A 213
ASP A 252
 None
 0.48A 4fxsA-3ffsA:
44.0		 4fxsA-3ffsA:
46.84
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.
4KTT_A_SAMA405_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 8 ALA A 155
ASP A 186
ILE A 185
ILE A 179
 None
 0.88A 4kttB-3ffsA:
undetectable		 4kttB-3ffsA:
24.12
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.
4KTT_C_SAMC404_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 8 ALA A 155
ASP A 186
ILE A 185
ILE A 179
 None
 0.86A 4kttD-3ffsA:
undetectable		 4kttD-3ffsA:
24.12
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.
4QD3_A_5AEA201_1
(PEPTIDYL-TRNA
HYDROLASE)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		5 / 9 LEU A  45
GLY A  66
ASN A 126
VAL A 345
VAL A 349
 None
 1.19A 4qd3A-3ffsA:
undetectable		 4qd3A-3ffsA:
18.75
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.
4YHA_C_MZMC303_1
(ALPHA-CARBONIC
ANHYDRASE)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		5 / 11 ASP A 186
VAL A 187
VAL A 189
LEU A 176
THR A 175
 None
 1.47A 4yhaC-3ffsA:
undetectable		 4yhaC-3ffsA:
21.39
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.
5KB6_A_ADNA401_1
(ADENOSINE KINASE)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		5 / 12 GLY A 262
ILE A 232
ALA A 269
ALA A 251
ILE A 235
 None
 0.82A 5kb6A-3ffsA:
undetectable		 5kb6A-3ffsA:
20.91
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.
5KB6_B_ADNB401_1
(ADENOSINE KINASE)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		5 / 12 GLY A 262
ILE A 232
ALA A 269
ALA A 251
ILE A 235
 None
 0.83A 5kb6B-3ffsA:
undetectable		 5kb6B-3ffsA:
20.91
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.
6FBN_B_SAMB401_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3ffs INOSINE-5-MONOPHOSPH
ATE DEHYDROGENASE
(Cryptosporidium
parvum) 		4 / 7 ALA A 155
ASP A 186
ILE A 185
ILE A 179
 None
 0.92A 6fbnA-3ffsA:
undetectable		 6fbnA-3ffsA:
24.12