Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "188cf4369e8539028b04f16ef6a76e9c",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 57.717,
"b": 57.717,
"c": 396.823,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [198.400,1.600],
"number_observations": 947224,
"number_observations_unique": 53792,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(meas)",
"value": 0.154
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.640,1.600],
"number_observations": 56846,
"number_observations_unique": 3866,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.642
},
{
"type": "R(meas)",
"value": 3.774
},
{
"type": "R(pim)",
"value": 0.982
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.700
},
{
"type": "CC(1/2)",
"value": 0.538
}
]
},
{
"resolution_limits": [198.400,7.160],
"number_observations": 11434,
"number_observations_unique": 806,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 31.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}