Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2d4ef4f958606adc2724ac27b560f806",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 130.001,
"b": 35.054,
"c": 60.833,
"alpha": 90.00,
"beta": 99.54,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.990,1.400],
"number_observations": 266420,
"number_observations_unique": 53215,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 9.200
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.430,1.400],
"number_observations": 13874,
"number_observations_unique": 2774,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.780
},
{
"type": "R(pim)",
"value": 0.381
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.722
}
]
},
{
"resolution_limits": [59.990,7.410],
"number_observations": 1000,
"number_observations_unique": 286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 16.600
},
{
"type": "Completeness",
"value": 71.700
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
}
]
}