Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c6fbc4f13b296a562ec209026844a515",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 57.982,
"b": 57.982,
"c": 395.142,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [197.640,1.440],
"number_observations": 1182152,
"number_observations_unique": 73456,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.103
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 13.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.100
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [1.480,1.440],
"number_observations": 56969,
"number_observations_unique": 5307,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.545
},
{
"type": "R(meas)",
"value": 1.623
},
{
"type": "R(pim)",
"value": 0.492
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 0.564
}
]
},
{
"resolution_limits": [197.640,6.440],
"number_observations": 15420,
"number_observations_unique": 1078,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 34.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.300
},
{
"type": "CC(1/2)",
"value": 0.963
}
]
}
]
}