Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cd7e7846872c0b527a86a1f63efb3dad",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 72.129,
"b": 193.850,
"c": 91.616,
"alpha": 90.00,
"beta": 113.24,
"gamma": 90.00
},
"wavelengths": [0.97200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.28,2.54],
"number_observations_unique": 52848,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "R(meas)",
"value": 0.182
},
{
"type": "R(pim)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 93.4
},
{
"type": "Redundancy",
"value": 5
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.78,2.54],
"number_observations_unique": 2640,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.036
},
{
"type": "R(meas)",
"value": 1.158
},
{
"type": "R(pim)",
"value": 0.509
},
{
"type": "CC(1/2)",
"value": 0.488
}
]
}
]
}