Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "451675da6c05668ee5929fedb6a8855b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 60.806,
"b": 48.118,
"c": 63.951,
"alpha": 90.0,
"beta": 90.3,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.120,1.360],
"number_observations": 523261,
"number_observations_unique": 79232,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.137
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.380,1.360],
"number_observations": 22066,
"number_observations_unique": 3864,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.997
},
{
"type": "R(meas)",
"value": 3.295
},
{
"type": "R(pim)",
"value": 1.338
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.265
}
]
},
{
"resolution_limits": [48.120,7.450],
"number_observations": 3719,
"number_observations_unique": 536,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 39.700
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}