Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "113a640802f0970f6da65409d346f0b2",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.640,
"b": 61.200,
"c": 32.536,
"alpha": 90.00,
"beta": 92.82,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.76,1.37],
"number_observations": 181537,
"number_observations_unique": 29822,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 14.7
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.39,1.37],
"number_observations": 5109,
"number_observations_unique": 1366,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.847
},
{
"type": "R(meas)",
"value": 2.152
},
{
"type": "R(pim)",
"value": 1.074
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.385
}
]
}
]
}