SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3brk'

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.
1EQH_A_FLPA701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 12 VAL X 376
VAL X  38
LEU X  29
GLY X  41
LEU X 361
 None
 1.02A 1eqhA-3brkX:
undetectable		 1eqhA-3brkX:
20.13
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.
1EQH_B_FLPB1701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 12 VAL X 376
VAL X  38
LEU X  29
GLY X  41
LEU X 361
 None
 1.03A 1eqhB-3brkX:
undetectable		 1eqhB-3brkX:
20.13
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.
1FSL_A_NIOA145_1
(LEGHEMOGLOBIN A)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		4 / 8 PHE X  92
ILE X  94
LEU X  51
VAL X  64
 None
 0.82A 1fslA-3brkX:
undetectable		 1fslA-3brkX:
16.54
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.
1GTI_B_CCSB47_0
(GLUTATHIONE
S-TRANSFERASE)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		4 / 7 THR X  66
LEU X  18
GLY X 134
LEU X  51
 None
 0.90A 1gtiB-3brkX:
undetectable		 1gtiB-3brkX:
19.71
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.
1GTI_E_CCSE47_0
(GLUTATHIONE
S-TRANSFERASE)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		4 / 7 THR X  66
LEU X  18
GLY X 134
LEU X  51
 None
 0.89A 1gtiE-3brkX:
undetectable		 1gtiE-3brkX:
19.71
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.
1V8B_B_ADNB1502_1
(ADENOSYLHOMOCYSTEINA
SE)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 12 LEU X  51
ASP X  48
THR X 301
LEU X  73
PHE X  92
 None
 1.25A 1v8bB-3brkX:
3.0		 1v8bB-3brkX:
21.57
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.
2J0D_A_ERYA1498_0
(CYTOCHROME P450 3A4)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 12 ARG X 402
PHE X 400
ILE X 410
ILE X 383
ALA X 370
 None
 1.04A 2j0dA-3brkX:
undetectable		 2j0dA-3brkX:
21.05
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.
2OXT_A_SAMA300_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		3 / 3 SER X 363
HIS X  76
ASP X  82
 None
 0.83A 2oxtA-3brkX:
undetectable		 2oxtA-3brkX:
21.25
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.
2OXT_C_SAMC300_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		4 / 4 SER X 363
GLY X 346
HIS X  76
ASP X  82
 None
 0.88A 2oxtC-3brkX:
undetectable		 2oxtC-3brkX:
21.25
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.
4A9K_B_TYLB2198_1
(CREB-BINDING PROTEIN)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		4 / 5 VAL X 376
LEU X 409
ILE X 273
VAL X  38
 None
 0.99A 4a9kB-3brkX:
undetectable		 4a9kB-3brkX:
14.25
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.
4EMA_A_BRLA601_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		3 / 3 PHE X  49
VAL X  64
ILE X  62
 None
 0.64A 4emaA-3brkX:
undetectable		 4emaA-3brkX:
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.
4PH9_A_IBPA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 10 VAL X 376
VAL X  38
LEU X  29
GLY X  41
LEU X 361
 None
 1.09A 4ph9A-3brkX:
undetectable		 4ph9A-3brkX:
21.92
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.
4PH9_B_IBPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 10 VAL X 376
VAL X  38
LEU X  29
GLY X  41
LEU X 361
 None
 1.08A 4ph9B-3brkX:
undetectable		 4ph9B-3brkX:
21.92
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.
4Z4I_A_IPHA904_0
(PROTEIN ARGONAUTE-2)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		4 / 6 ASP X  12
ALA X 125
THR X 213
TYR X 128
 None
 1.40A 4z4iA-3brkX:
2.2		 4z4iA-3brkX:
19.06
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.
5I6X_A_8PRA705_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 10 ASP X  48
ALA X  15
ILE X  62
GLY X 134
SER X  52
 None
 1.26A 5i6xA-3brkX:
undetectable		 5i6xA-3brkX:
21.02
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.
5LSA_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 12 VAL X 360
GLY X  41
TYR X  39
ILE X 137
ARG X 268
 None
None
SO4  X 601 (-4.6A)
None
None
 1.44A 5lsaA-3brkX:
2.4		 5lsaA-3brkX:
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.
5N0S_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 12 ILE X 333
VAL X 323
SER X 321
ILE X 366
ALA X 349
 None
 1.18A 5n0sB-3brkX:
undetectable		 5n0sB-3brkX:
20.95
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.
5UTU_F_ADNF503_1
(ADENOSYLHOMOCYSTEINA
SE)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 12 LEU X  51
ASP X  48
THR X 301
LEU X  73
PHE X  92
 None
 1.26A 5utuF-3brkX:
2.2		 5utuF-3brkX:
21.11
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.
6AUU_A_ACTA804_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		3 / 3 GLN X 278
TRP X 277
VAL X 359
 None
 0.74A 6auuA-3brkX:
undetectable		 6auuA-3brkX:
20.65
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.
6GIQ_T_PCFT101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		4 / 8 SER X  98
TYR X  16
GLY X 207
SER X 205
 None
 1.03A 6giqL-3brkX:
undetectable
6giqP-3brkX:
undetectable
6giqT-3brkX:
undetectable		 6giqL-3brkX:
23.95
6giqP-3brkX:
19.08
6giqT-3brkX:
10.48
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.
6HU9_T_PCFT101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)		 3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
(Agrobacterium
tumefaciens) 		5 / 10 SER X  98
TYR X  16
GLY X 207
SER X 205
ALA X 204
 None
 1.45A 6hu9L-3brkX:
undetectable
6hu9P-3brkX:
undetectable
6hu9T-3brkX:
undetectable		 6hu9L-3brkX:
23.37
6hu9P-3brkX:
19.18
6hu9T-3brkX:
10.48