Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f7c1c2b485beeaabb2b51a79b731466c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.40,
"b": 66.57,
"c": 55.08,
"alpha": 90.00,
"beta": 101.58,
"gamma": 90.00
},
"wavelengths": [0.92820],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.280,1.380],
"number_observations": 171453,
"number_observations_unique": 63516,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 18.000
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.420,1.380],
"number_observations_unique": 4373,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.787
},
{
"type": "R(meas)",
"value": 1.009
},
{
"type": "R(pim)",
"value": 0.624
},
{
"type": "Completeness",
"value": 89.400
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.612
}
]
},
{
"resolution_limits": [33.280,6.170],
"number_observations_unique": 713,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "Completeness",
"value": 93.200
},
{
"type": "Redundancy",
"value": 2.800
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}