Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1d1b7e9e48aa71fe1ace7c3e044fd7a2",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 81.736,
"b": 112.087,
"c": 62.299,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.040,1.480],
"number_observations": 624764,
"number_observations_unique": 47850,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 17.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 13.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.510,1.480],
"number_observations": 30314,
"number_observations_unique": 2329,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.741
},
{
"type": "R(meas)",
"value": 1.810
},
{
"type": "R(pim)",
"value": 0.492
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 13.000
},
{
"type": "CC(1/2)",
"value": 0.657
}
]
},
{
"resolution_limits": [66.040,8.110],
"number_observations": 4221,
"number_observations_unique": 351,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 75.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}