Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ead8d1f2359cb9b65a485b28f27bff33",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 89.593,
"b": 89.593,
"c": 106.363,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.96874],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.68,1.860],
"number_observations": 337879,
"number_observations_unique": 41976,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "R(meas)",
"value": 0.132
},
{
"type": "I/SigI",
"value": 9.8
},
{
"type": "Completeness",
"value": 99.95
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.89,1.86],
"number_observations": 15033,
"number_observations_unique": 2031,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.742
},
{
"type": "R(meas)",
"value": 1.873
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Completeness",
"value": 99.66
},
{
"type": "CC(1/2)",
"value": 0.301
}
]
},
{
"resolution_limits": [62.72,5.05],
"number_observations": 17137,
"number_observations_unique": 2265,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 39.7
},
{
"type": "Completeness",
"value": 99.74
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
}
]
}