Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b10d248048c5482e021fb3843216b9f2",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 239.540,
"b": 239.540,
"c": 132.569,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.940,3.150],
"number_observations": 219210,
"number_observations_unique": 63411,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 10.100
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [3.230,3.150],
"number_observations": 15487,
"number_observations_unique": 4523,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.627
},
{
"type": "R(pim)",
"value": 0.360
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.705
}
]
},
{
"resolution_limits": [24.940,14.440],
"number_observations": 1781,
"number_observations_unique": 537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 30.400
},
{
"type": "Completeness",
"value": 70.400
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}