Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0469264220ecc9037f2bc5aed1c61b43",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 38.195,
"b": 74.965,
"c": 83.102,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.550,1.620],
"number_observations": 220424,
"number_observations_unique": 31170,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.242
},
{
"type": "R(meas)",
"value": 0.261
},
{
"type": "R(pim)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 7.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.100
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.650,1.620],
"number_observations": 10882,
"number_observations_unique": 1520,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.782
},
{
"type": "R(meas)",
"value": 3.001
},
{
"type": "R(pim)",
"value": 1.119
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.224
}
]
},
{
"resolution_limits": [41.550,8.870],
"number_observations": 1382,
"number_observations_unique": 245,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 25.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}