Datasets:

ClarusC64
/

alphafold-interface-coherence-baseline-mapping-v0.1

id stringclasses 10 values	complex_id stringclasses 10 values	partner_a stringclasses 10 values	partner_b stringclasses 10 values	interface_residue_count int64 28 75	contact_density float64 0.49 0.8	baseline_deltaG_bind float64 -14.2 -8.4	baseline_kd_nM float64 0.9 55	contact_stability_score float64 0.63 0.91	hotspot_integrity_score float64 0.52 0.89	allosteric_cross_interface_score float64 0.44 0.78	interface_coherence_score float64 0.58 0.9	signal_paths stringclasses 10 values	baseline_failure_margin float64 0.12 0.36	notes stringclasses 10 values	constraints stringclasses 1 value	gold_checklist stringclasses 1 value
ICBM-001	CX-ALPHA-01	KinaseA	RegB	42	0.68	-10.8	8.5	0.81	0.76	0.62	0.78	A:120>135>148\|B:55>60>72	0.24	Tight interface	<=300 words	coherence+paths+margin
ICBM-002	CX-ALPHA-02	TFX	CoActY	35	0.54	-9.2	22	0.72	0.61	0.58	0.69	A:44>51>70\|B:180>192>201	0.19	Moderate coupling	<=300 words	coherence+paths+margin
ICBM-003	CX-ALPHA-03	EnzC	ScafD	58	0.73	-12.1	3.2	0.86	0.83	0.7	0.84	A:210>228>240\|B:12>18>30	0.3	High coherence	<=300 words	coherence+paths+margin
ICBM-004	CX-ALPHA-04	ReceptorE	LigF	28	0.49	-8.4	55	0.63	0.52	0.44	0.58	A:15>22>31\|B:88>95>110	0.12	Shallow interface	<=300 words	coherence+paths+margin
ICBM-005	CX-ALPHA-05	ProtG	ProtH	64	0.77	-13	1.8	0.88	0.85	0.74	0.86	A:300>318>330\|B:140>152>165	0.33	Robust hotspot core	<=300 words	coherence+paths+margin
ICBM-006	CX-ALPHA-06	ChaperI	ClientJ	46	0.61	-10.1	12.5	0.79	0.68	0.57	0.73	A:90>102>118\|B:400>412>430	0.21	Client-specific coupling	<=300 words	coherence+paths+margin
ICBM-007	CX-ALPHA-07	SignalK	AdaptorL	31	0.52	-9	28	0.7	0.6	0.51	0.66	A:5>11>19\|B:210>222>235	0.17	Edge contacts matter	<=300 words	coherence+paths+margin
ICBM-008	CX-ALPHA-08	ComplexM	ComplexN	75	0.8	-14.2	0.9	0.91	0.89	0.78	0.9	A:155>170>188\|B:60>72>90	0.36	Very high coherence	<=300 words	coherence+paths+margin
ICBM-009	CX-ALPHA-09	MotorO	TrackP	38	0.57	-9.6	18	0.74	0.66	0.55	0.7	A:240>255>270\|B:20>28>40	0.2	Directionality signal	<=300 words	coherence+paths+margin
ICBM-010	CX-ALPHA-10	EnzQ	RegR	53	0.7	-11.4	5.6	0.83	0.79	0.67	0.81	A:60>74>88\|B:310>326>340	0.28	Coherent interface basin	<=300 words	coherence+paths+margin

What this dataset tests

Whether a model can construct
a stable baseline map
of protein–protein interface coherence.

This is the intact coupling state.
No stress applied.
No mutation applied.

The target is the interface basin.

Inputs

interface_residue_count
contact_density
baseline_deltaG_bind
baseline_kd_nM
contact_stability_score
hotspot_integrity_score
allosteric_cross_interface_score

Required outputs

interface_coherence_score
signal_paths
baseline_failure_margin

Task

Given baseline interface metrics
predict:

interface coherence score
cross-interface signal paths
the failure margin before instability

Use cases

Biologic complex design
Synthetic pathway assembly
Protein engineering QC
Baseline maps for stress testing

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