SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2zau'

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.
1RB3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 10 ILE A 302
ALA A 216
ILE A 324
ILE A 167
THR A 215
 None
 1.23A 1rb3A-2zauA:
undetectable		 1rb3A-2zauA:
21.54
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.
1WRK_A_TFPA204_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 9 VAL A 220
LEU A 225
SER A 253
PHE A 244
LEU A 168
 None
 1.33A 1wrkA-2zauA:
undetectable
1wrkB-2zauA:
undetectable		 1wrkA-2zauA:
13.29
1wrkB-2zauA:
13.29
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.
2BXQ_A_P1ZA2002_1
(SERUM ALBUMIN)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		6 / 12 LEU A 143
PHE A 141
LEU A 121
LEU A 118
ILE A 114
ALA A  74
 None
 1.33A 2bxqA-2zauA:
undetectable		 2bxqA-2zauA:
19.73
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.
2F78_A_BEZA1003_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 7 SER A  82
LEU A 299
HIS A 228
THR A 221
 None
 1.13A 2f78A-2zauA:
undetectable		 2f78A-2zauA:
20.38
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.
2F78_B_BEZB1004_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 7 SER A  82
LEU A 299
HIS A 228
THR A 221
 None
 1.07A 2f78B-2zauA:
undetectable		 2f78B-2zauA:
20.38
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.
3CFQ_A_DIFA1_1
(TRANSTHYRETIN)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 6 LEU A 129
ALA A 146
LEU A  95
SER A 144
 None
 1.04A 3cfqA-2zauA:
undetectable		 3cfqA-2zauA:
18.57
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.
3CYX_A_ROCA201_4
(HIV-1 PROTEASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 4 LEU A 177
ASP A  68
VAL A  65
THR A 294
 None
 1.00A 3cyxB-2zauA:
undetectable		 3cyxB-2zauA:
19.84
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.
3JB2_A_SAMA1101_1
(STRUCTURAL PROTEIN
VP3)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		3 / 3 GLU A 112
ASP A  68
ASP A 119
 None
 0.63A 3jb2A-2zauA:
undetectable		 3jb2A-2zauA:
15.99
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.
3KO0_N_TFPN201_1
(PROTEIN S100-A4)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 10 GLY A 224
PHE A 223
GLY A 297
CYH A 233
ILE A 232
 None
 1.29A 3ko0L-2zauA:
undetectable
3ko0N-2zauA:
undetectable		 3ko0L-2zauA:
19.15
3ko0N-2zauA:
19.15
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 12 ILE A 178
THR A 174
ILE A 195
ILE A  75
VAL A  66
 None
 1.04A 3kpdC-2zauA:
undetectable		 3kpdC-2zauA:
17.28
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.
3LN1_A_CELA682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 8 LEU A 289
SER A 290
LEU A 166
ILE A 172
 None
 0.80A 3ln1A-2zauA:
undetectable		 3ln1A-2zauA:
20.78
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.
3LN1_B_CELB682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 7 LEU A 289
SER A 290
LEU A 166
ILE A 172
 None
 0.81A 3ln1B-2zauA:
undetectable		 3ln1B-2zauA:
20.78
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.
3LS4_H_TCIH220_1
(HEAVY CHAIN OF
ANTIBODY FAB
FRAGMENT)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 10 VAL A 293
VAL A 220
LEU A 299
GLY A 224
GLY A 227
 None
 1.21A 3ls4H-2zauA:
undetectable		 3ls4H-2zauA:
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.
3UJ7_A_SAMA301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 12 LEU A  81
GLY A  73
ARG A 115
ASP A 119
ALA A 117
 None
 1.12A 3uj7A-2zauA:
undetectable		 3uj7A-2zauA:
24.33
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.
3UJ7_B_SAMB302_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 12 LEU A  81
GLY A  73
ARG A 115
ASP A 119
ALA A 117
 None
 1.12A 3uj7B-2zauA:
undetectable		 3uj7B-2zauA:
24.33
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.
3V4T_H_ACTH503_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 7 ALA A 329
ILE A 238
ARG A 241
GLY A 163
 None
 0.85A 3v4tH-2zauA:
undetectable		 3v4tH-2zauA:
23.56
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.
4DC3_B_2FAB401_1
(ADENOSINE KINASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		6 / 12 LEU A 177
GLY A 297
ASN A 202
VAL A 293
THR A 174
ASN A  79
 None
 1.39A 4dc3B-2zauA:
undetectable		 4dc3B-2zauA:
20.77
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.
4IKI_B_IMNB201_1
(TRANSTHYRETIN)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 6 LEU A 129
ALA A 146
LEU A  95
SER A 144
 None
 1.01A 4ikiB-2zauA:
undetectable		 4ikiB-2zauA:
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.
4JJK_A_FOLA601_0
(FORMATE--TETRAHYDROF
OLATE LIGASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 8 ASN A 231
ALA A 229
LEU A 166
LEU A 299
 None
 0.98A 4jjkA-2zauA:
3.1		 4jjkA-2zauA:
20.25
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.
4N48_A_SAMA601_0
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 12 GLY A 296
GLY A 297
ILE A  62
THR A  63
GLY A 222
 None
 1.17A 4n48A-2zauA:
undetectable		 4n48A-2zauA:
22.38
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.
4N48_B_SAMB601_0
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 12 GLY A 296
GLY A 297
ILE A  62
THR A  63
GLY A 222
 None
 1.17A 4n48B-2zauA:
undetectable		 4n48B-2zauA:
22.38
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.
4OLT_B_GCSB303_1
(CHITOSANASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 6 ILE A  62
ASP A  60
GLY A 222
VAL A 220
 None
 1.08A 4oltB-2zauA:
undetectable		 4oltB-2zauA:
21.97
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.
4Z90_F_4LEF402_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 7 LEU A 226
ALA A 229
LEU A 333
ALA A 240
LEU A 289
 None
 0.97A 4z90F-2zauA:
undetectable
4z90G-2zauA:
undetectable
4z90H-2zauA:
undetectable
4z90J-2zauA:
undetectable		 4z90F-2zauA:
22.10
4z90G-2zauA:
22.10
4z90H-2zauA:
22.10
4z90J-2zauA:
22.10
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.
5HWA_A_GCSA301_1
(CHITOSANASE)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		4 / 8 ASP A  60
GLY A 296
THR A 221
LEU A 298
 None
 1.03A 5hwaA-2zauA:
undetectable		 5hwaA-2zauA:
20.19
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.
5ODI_G_ACTG702_0
(HETERODISULFIDE
REDUCTASE, SUBUNIT A)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		3 / 3 GLY A 296
THR A 169
ASN A 202
 None
 0.71A 5odiG-2zauA:
undetectable		 5odiG-2zauA:
19.39
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.
5UBB_A_SAMA301_0
(ALPHA N-TERMINAL
PROTEIN
METHYLTRANSFERASE 1B)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 12 GLY A 297
LEU A 168
VAL A 220
HIS A 228
LEU A 225
 None
 1.30A 5ubbA-2zauA:
undetectable		 5ubbA-2zauA:
20.74
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.
6DM0_B_CYZB1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 2zau SELENIDE, WATER
DIKINASE
(Aquifex
aeolicus) 		5 / 10 LEU A 288
LEU A 226
ILE A 176
PRO A 263
GLY A 175
 None
None
None
PO4  A 902 (-4.7A)
None
 1.31A 6dm0B-2zauA:
undetectable
6dm0C-2zauA:
2.2		 6dm0B-2zauA:
12.87
6dm0C-2zauA:
12.87