Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7097ec5cf165c3cb31ee4d7a37380360",
"space_group_name": "P 42 21 2",
"unit_cell": {
"a": 103.632,
"b": 103.632,
"c": 49.676,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.391,2.080],
"number_observations": 323801,
"number_observations_unique": 14330,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 28.900
},
{
"type": "Completeness",
"value": 86.700
},
{
"type": "Redundancy",
"value": 22.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.148,2.080],
"number_observations": 11158,
"number_observations_unique": 713,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.039
},
{
"type": "R(meas)",
"value": 2.109
},
{
"type": "R(pim)",
"value": 0.520
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 62.800
},
{
"type": "Redundancy",
"value": 15.600
},
{
"type": "CC(1/2)",
"value": 0.434
}
]
},
{
"resolution_limits": [73.391,6.232],
"number_observations": 14311,
"number_observations_unique": 718,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 71.400
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}