Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0ce17ade71da3219f9c19959899ca9c7",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 37.147,
"b": 35.259,
"c": 63.494,
"alpha": 90.0,
"beta": 102.3,
"gamma": 90.0
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.720,1.700],
"number_observations_unique": 8933,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 11.39
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 3.47
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.81,1.700],
"number_observations_unique": 2670,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.542
},
{
"type": "I/SigI",
"value": 2.23
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 3.39
},
{
"type": "CC(1/2)",
"value": 0.829
}
]
},
{
"resolution_limits": [1.93,1.81],
"number_observations_unique": 2584,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.325
},
{
"type": "I/SigI",
"value": 3.88
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 3.44
},
{
"type": "CC(1/2)",
"value": 0.926
}
]
}
]
}