Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2c5d1684a09d723565114e71e0be497d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 55.05,
"b": 105.29,
"c": 153.81,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.050,2.400],
"number_observations_unique": 35049,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.295
},
{
"type": "R(meas)",
"value": 0.330
},
{
"type": "R(pim)",
"value": 0.145
},
{
"type": "I/SigI",
"value": 8.300
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [2.490,2.400],
"number_observations_unique": 3466,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.618
},
{
"type": "R(meas)",
"value": 2.930
},
{
"type": "R(pim)",
"value": 1.290
},
{
"type": "Completeness",
"value": 93.900
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.408
}
]
},
{
"resolution_limits": [55.050,8.980],
"number_observations_unique": 765,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}