Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ce75a25df93d5595f3dbf4d998922b16",
"space_group_name": "P 1",
"unit_cell": {
"a": 47.597,
"b": 67.281,
"c": 86.417,
"alpha": 74.04,
"beta": 77.55,
"gamma": 83.76
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.900],
"number_observations_unique": 76172,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "I/SigI",
"value": 7.100
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 3.600
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations_unique": 6688,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.462
},
{
"type": "Completeness",
"value": 84.40
},
{
"type": "Redundancy",
"value": 2.80
}
]
},
{
"resolution_limits": [2.05,1.97],
"number_observations_unique": 7440,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.365
},
{
"type": "Completeness",
"value": 94.40
},
{
"type": "Redundancy",
"value": 3.20
}
]
},
{
"resolution_limits": [2.14,2.05],
"number_observations_unique": 7620,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.306
},
{
"type": "Completeness",
"value": 96.80
},
{
"type": "Redundancy",
"value": 3.60
}
]
},
{
"resolution_limits": [2.25,2.14],
"number_observations_unique": 7715,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.250
},
{
"type": "Completeness",
"value": 97.50
},
{
"type": "Redundancy",
"value": 3.70
}
]
},
{
"resolution_limits": [2.39,2.25],
"number_observations_unique": 7781,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "Completeness",
"value": 97.70
},
{
"type": "Redundancy",
"value": 3.90
}
]
},
{
"resolution_limits": [2.58,2.39],
"number_observations_unique": 7687,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "Completeness",
"value": 97.90
},
{
"type": "Redundancy",
"value": 3.90
}
]
},
{
"resolution_limits": [2.84,2.58],
"number_observations_unique": 7807,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "Completeness",
"value": 98.30
},
{
"type": "Redundancy",
"value": 3.90
}
]
},
{
"resolution_limits": [3.25,2.84],
"number_observations_unique": 7773,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "Completeness",
"value": 98.50
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [4.09,3.25],
"number_observations_unique": 7834,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [50.00,4.09],
"number_observations_unique": 7827,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "Completeness",
"value": 99.00
},
{
"type": "Redundancy",
"value": 3.70
}
]
}
]
}