Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "08b52e549c42677e5ef728e236ff26d3",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 77.238,
"b": 77.238,
"c": 37.112,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54056],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [13.380,1.600],
"number_observations": 73015,
"number_observations_unique": 15294,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 11.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.935
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 2265,
"number_observations_unique": 762,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.031
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.023
}
]
},
{
"resolution_limits": [13.380,8.620],
"number_observations": 464,
"number_observations_unique": 82,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 27.900
},
{
"type": "Completeness",
"value": 69.800
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}