Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "057a9c8dc0cd197683a449b81fcf4a06",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 98.920,
"b": 63.050,
"c": 120.436,
"alpha": 90.00,
"beta": 93.49,
"gamma": 90.00
},
"wavelengths": [1.00802],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.4,1.87],
"number_observations_unique": 119947,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.140
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 13.5
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 19.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.90,1.87],
"number_observations_unique": 4833,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.669
},
{
"type": "R(pim)",
"value": 0.246
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Completeness",
"value": 80.1
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.809
}
]
}
]
}