Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ae2551b7a5902b6615e02e96683d783",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.137,
"b": 33.645,
"c": 60.243,
"alpha": 90.00,
"beta": 95.75,
"gamma": 90.00
},
"wavelengths": [0.92204],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.94,1.15],
"number_observations": 209179,
"number_observations_unique": 38405,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 25.3
},
{
"type": "Completeness",
"value": 72.7
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.170,1.150],
"number_observations": 145,
"number_observations_unique": 144,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 5.600
},
{
"type": "Redundancy",
"value": 1.000
},
{
"type": "CC(1/2)",
"value": 0.974
}
]
},
{
"resolution_limits": [36.940,6.300],
"number_observations": 2038,
"number_observations_unique": 354,
"quality_factors": [
{
"type": "I/SigI",
"value": 74.000
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 5.800
}
]
}
]
}