Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cfa7bc596b1b02a2c9affd6ff5a13abb",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 86.455,
"b": 89.340,
"c": 131.172,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [22.72,1.700],
"number_observations_unique": 107831,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 10.700
},
{
"type": "Completeness",
"value": 96.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.70],
"number_observations_unique": 10211,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.426
},
{
"type": "Completeness",
"value": 92.30
}
]
},
{
"resolution_limits": [1.83,1.76],
"number_observations_unique": 10418,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.313
},
{
"type": "Completeness",
"value": 93.70
}
]
},
{
"resolution_limits": [1.91,1.83],
"number_observations_unique": 10487,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.244
},
{
"type": "Completeness",
"value": 94.30
}
]
},
{
"resolution_limits": [2.02,1.91],
"number_observations_unique": 10573,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.174
},
{
"type": "Completeness",
"value": 95.00
}
]
},
{
"resolution_limits": [2.14,2.02],
"number_observations_unique": 10668,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "Completeness",
"value": 95.70
}
]
},
{
"resolution_limits": [2.31,2.14],
"number_observations_unique": 10776,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "Completeness",
"value": 96.30
}
]
},
{
"resolution_limits": [2.54,2.31],
"number_observations_unique": 10875,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "Completeness",
"value": 97.20
}
]
},
{
"resolution_limits": [2.91,2.54],
"number_observations_unique": 11031,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 97.90
}
]
},
{
"resolution_limits": [3.66,2.91],
"number_observations_unique": 11191,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "Completeness",
"value": 98.70
}
]
},
{
"resolution_limits": [50.00,3.66],
"number_observations_unique": 11601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "Completeness",
"value": 99.00
}
]
}
]
}