Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6bb21743987e12856983ed78a0a25e68",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.750,
"b": 67.854,
"c": 138.385,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.160,2.010],
"number_observations": 294317,
"number_observations_unique": 43273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.273
},
{
"type": "R(meas)",
"value": 0.296
},
{
"type": "R(pim)",
"value": 0.113
},
{
"type": "I/SigI",
"value": 6.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.960
}
]
},
"refln_shells": [
{
"resolution_limits": [2.060,2.010],
"number_observations": 21673,
"number_observations_unique": 3114,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.296
},
{
"type": "R(meas)",
"value": 3.563
},
{
"type": "R(pim)",
"value": 1.344
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.349
}
]
},
{
"resolution_limits": [69.160,8.990],
"number_observations": 3232,
"number_observations_unique": 582,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 34.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.798
}
]
}
]
}