Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c3c07affe0471ba5e4c8314f1e03d15a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 103.333,
"b": 44.257,
"c": 62.137,
"alpha": 90.00,
"beta": 98.31,
"gamma": 90.00
},
"wavelengths": [1.28210],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.440,1.540],
"number_observations": 83577,
"number_observations_unique": 35888,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 5.500
},
{
"type": "Completeness",
"value": 87.800
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.570,1.540],
"number_observations_unique": 1306,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.075
},
{
"type": "R(meas)",
"value": 1.391
},
{
"type": "R(pim)",
"value": 0.875
},
{
"type": "Completeness",
"value": 65.300
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.144
}
]
},
{
"resolution_limits": [42.440,8.450],
"number_observations_unique": 248,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "Completeness",
"value": 90.100
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}