Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9eabe56bb06861358b82a83ad9b27fda",
"space_group_name": "P 42 21 2",
"unit_cell": {
"a": 147.136,
"b": 147.136,
"c": 80.108,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [144.150,3.120],
"number_observations": 392913,
"number_observations_unique": 15333,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.516
},
{
"type": "R(meas)",
"value": 0.527
},
{
"type": "R(pim)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 6.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.600
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [3.340,3.120],
"number_observations": 72125,
"number_observations_unique": 2704,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.520
},
{
"type": "R(meas)",
"value": 4.607
},
{
"type": "R(pim)",
"value": 0.887
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.700
},
{
"type": "CC(1/2)",
"value": 0.437
}
]
},
{
"resolution_limits": [144.150,8.820],
"number_observations": 16536,
"number_observations_unique": 785,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.168
},
{
"type": "R(meas)",
"value": 0.172
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 22.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.100
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}