Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "23f682052fbd5949f36db71eb9ecc0ac",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.62,
"b": 70.43,
"c": 59.99,
"alpha": 90.00,
"beta": 109.43,
"gamma": 90.00
},
"wavelengths": [0.93340],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.29,1.65],
"number_observations": 141578,
"number_observations_unique": 45732,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 15.9
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.65],
"number_observations": 6973,
"number_observations_unique": 2270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.486
},
{
"type": "R(meas)",
"value": 0.592
},
{
"type": "R(pim)",
"value": 0.333
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.734
}
]
}
]
}