Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f2ee2ac0b1d2c54cf8ac3ace2924a6e0",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 56.108,
"b": 56.495,
"c": 101.613,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.050,3.580],
"number_observations": 21374,
"number_observations_unique": 3814,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "R(meas)",
"value": 0.144
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 18.900
},
{
"type": "Completeness",
"value": 92.300
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
},
"refln_shells": [
{
"resolution_limits": [3.670,3.580],
"number_observations": 898,
"number_observations_unique": 241,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.256
},
{
"type": "R(meas)",
"value": 0.300
},
{
"type": "R(pim)",
"value": 0.152
},
{
"type": "I/SigI",
"value": 12.000
},
{
"type": "Completeness",
"value": 81.200
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.948
}
]
},
{
"resolution_limits": [29.050,16.010],
"number_observations": 266,
"number_observations_unique": 54,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 33.700
},
{
"type": "Completeness",
"value": 85.100
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}