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iPPIDB
ippidb-web
Commits
798aa3b8
Commit
798aa3b8
authored
5 years ago
by
Hervé MENAGER
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add E2E yaml test data for issue #208
parent
15a197bb
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Pipeline
#28700
passed
5 years ago
Stage: test
Stage: deploy
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ippisite/ippidb/tests/test_simple_heterodimer_208.yaml
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57 additions, 0 deletions
ippisite/ippidb/tests/test_simple_heterodimer_208.yaml
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ippisite/ippidb/tests/test_simple_heterodimer_208.yaml
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View file @
798aa3b8
source
:
DO
id_source
:
'
10.1021/jm300608w'
in_vitro
:
true
in_cellulo
:
true
xray
:
true
pdb_id
:
1g5j
complexChoice
:
inhibited
complexType
:
Inhib_Hetero2merAB
complex
:
-
cc_nb
:
1
complex_type
:
Partner
domain_pfam_acc
:
null
ppc_copy_nb
:
1
ppp_copy_nb_per_p
:
'
'
uniprot_id
:
Q92934
-
cc_nb
:
1
complex_type
:
Bound
domain_pfam_acc
:
null
ppc_copy_nb
:
1
ppp_copy_nb_per_p
:
1
uniprot_id
:
Q07817
family_name
:
BCL-XL / Bad
diseases
:
-
;cancer;MONDO:0004992;
compounds
:
-
common_name
:
compound_name
:
compound
12
ligand_id
:
03B
molecule_smiles
:
CN(C)CC[C@H](CSc1ccccc1)Nc2ccc(cc2[N+]([O-])=O)[S](=O)(=O)Nc3ccc(cc3)N4CCN(CC4)c5cccc(c5)c6c(n(C)c(C)c6C(O)=O)c7ccc(CI)cc7
activity_tests
:
-
test_type
:
BIOCH
test_name
:
Fluorescence Polarization
protein_bound_construct
:
U
test_modulation_type
:
I
nb_active_compounds
:
1
cell_line_name
:
'
'
protein_complex
:
'
1'
compound_activity_results
:
-
activity_mol
:
6
activity_type
:
pIC50
activity_unit
:
1e-9
compound_name
:
'
compound
12'
modulation_type
:
I
-
test_type
:
CELL
test_name
:
cell growth inhibition
protein_bound_construct
:
U
test_modulation_type
:
I
nb_active_compounds
:
1
cell_line_name
:
'
Human
small-cell
lung
cancer'
protein_complex
:
'
1'
compound_activity_results
:
-
activity_mol
:
61
activity_type
:
pIC50
activity_unit
:
1e-9
compound_name
:
'
compound
12'
modulation_type
:
I
\ No newline at end of file
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