Datasets:
Formats:
csv
Languages:
English
Size:
< 1K
Tags:
clarusc64
alphafold
alphafold-multimer
protein-protein-interactions
stress-testing
interface-stability
License:
id
string | complex_id
string | partner_a
string | partner_b
string | stress_type
string | stress_level
float64 | baseline_interface_coherence
float64 | baseline_kd_nM
float64 | baseline_contact_stability
float64 | baseline_allosteric_cross_interface_score
float64 | stressed_interface_coherence
float64 | stressed_kd_nM
float64 | contact_loss_fraction
float64 | decoherence_onset_score
float64 | stress_sensitivity_vector
string | contact_loss_nodes
string | functional_risk_flag
int64 | stabilization_hint
string | notes
string | constraints
string | gold_checklist
string |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
IDS-001
|
CX-ALPHA-01
|
KinaseA
|
RegB
|
pH
| 6.2
| 0.78
| 8.5
| 0.81
| 0.62
| 0.52
| 26
| 0.24
| 0.63
|
pH:-0.26,temp:-0.08,ox:+0.02
|
A:135,148|B:60,72
| 1
|
buffer_shift
|
pH drives contact loss
|
<=320 words
|
onset+nodes+risk
|
IDS-002
|
CX-ALPHA-02
|
TFX
|
CoActY
|
temp_C
| 41
| 0.69
| 22
| 0.72
| 0.58
| 0.48
| 80
| 0.31
| 0.71
|
pH:-0.10,temp:-0.33,ox:-0.04
|
A:51,70|B:192,201
| 1
|
cooling+salt
|
Thermal sensitivity
|
<=320 words
|
onset+nodes+risk
|
IDS-003
|
CX-ALPHA-03
|
EnzC
|
ScafD
|
oxidative_mM_H2O2
| 0.8
| 0.84
| 3.2
| 0.86
| 0.7
| 0.74
| 6.5
| 0.12
| 0.42
|
pH:-0.04,temp:-0.09,ox:-0.10
|
A:228|B:18
| 0
|
antioxidant
|
Mild drift only
|
<=320 words
|
onset+nodes+risk
|
IDS-004
|
CX-ALPHA-04
|
ReceptorE
|
LigF
|
temp_C
| 39
| 0.58
| 55
| 0.63
| 0.44
| 0.34
| 210
| 0.4
| 0.84
|
pH:-0.12,temp:-0.24,ox:-0.05
|
A:22,31|B:95,110
| 1
|
cooling+affinity_patch
|
Shallow interface fails fast
|
<=320 words
|
onset+nodes+risk
|
IDS-005
|
CX-ALPHA-05
|
ProtG
|
ProtH
|
pH
| 5.8
| 0.86
| 1.8
| 0.88
| 0.74
| 0.6
| 9.8
| 0.22
| 0.58
|
pH:-0.28,temp:-0.12,ox:-0.06
|
A:318|B:152,165
| 1
|
buffer_shift
|
Hotspot stable, edges fail
|
<=320 words
|
onset+nodes+risk
|
IDS-006
|
CX-ALPHA-06
|
ChaperI
|
ClientJ
|
oxidative_mM_H2O2
| 1.2
| 0.73
| 12.5
| 0.79
| 0.57
| 0.41
| 95
| 0.37
| 0.79
|
pH:-0.06,temp:-0.14,ox:-0.32
|
A:102,118|B:412,430
| 1
|
reducing_agent
|
Client coupling collapses
|
<=320 words
|
onset+nodes+risk
|
IDS-007
|
CX-ALPHA-07
|
SignalK
|
AdaptorL
|
pH
| 6
| 0.66
| 28
| 0.7
| 0.51
| 0.47
| 92
| 0.28
| 0.67
|
pH:-0.19,temp:-0.07,ox:-0.03
|
A:11,19|B:222,235
| 1
|
buffer_shift
|
Network thinning
|
<=320 words
|
onset+nodes+risk
|
IDS-008
|
CX-ALPHA-08
|
ComplexM
|
ComplexN
|
temp_C
| 42
| 0.9
| 0.9
| 0.91
| 0.78
| 0.79
| 1.6
| 0.08
| 0.28
|
pH:-0.05,temp:-0.11,ox:-0.02
|
A:170|B:72
| 0
|
none
|
Robust under heat
|
<=320 words
|
onset+nodes+risk
|
IDS-009
|
CX-ALPHA-09
|
MotorO
|
TrackP
|
oxidative_mM_H2O2
| 0.6
| 0.7
| 18
| 0.74
| 0.55
| 0.5
| 70
| 0.29
| 0.69
|
pH:-0.04,temp:-0.08,ox:-0.24
|
A:255|B:28,40
| 1
|
antioxidant
|
Oxidation hits coupling
|
<=320 words
|
onset+nodes+risk
|
IDS-010
|
CX-ALPHA-10
|
EnzQ
|
RegR
|
temp_C
| 40
| 0.81
| 5.6
| 0.83
| 0.67
| 0.61
| 14.5
| 0.19
| 0.55
|
pH:-0.08,temp:-0.20,ox:-0.03
|
A:74|B:326,340
| 0
|
cooling
|
Drift without failure
|
<=320 words
|
onset+nodes+risk
|
What this dataset tests
Whether a model can detect
stress-induced interface decoherence
before full dissociation.
Stress modes covered
pH shift
heat stress
oxidative stress
The failure mode
Contact maps stop predicting binding
and cross-interface signal transmission weakens.
Inputs
stress_type
stress_level
baseline_interface_coherence
baseline_kd_nM
baseline_contact_stability
baseline_allosteric_cross_interface_score
stressed_interface_coherence
stressed_kd_nM
contact_loss_fraction
Required outputs
decoherence_onset_score
contact_loss_nodes
functional_risk_flag
stabilization_hint
Task
Given baseline and stressed measurements
predict:
- early decoherence onset score
- which interface nodes failed
- whether function risk is triggered
- the first stabilization move
Use cases
Biologics stability screening
Synthetic complex design
Cell-condition robustness testing
Early warning for interface failure
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