Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "646e6471e3425130f1d7875b531bb62c",
"space_group_name": "P 1",
"unit_cell": {
"a": 24.823,
"b": 34.331,
"c": 129.067,
"alpha": 90.86,
"beta": 90.00,
"gamma": 111.19
},
"wavelengths": [0.97856],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.850],
"number_observations": 64982,
"number_observations_unique": 32888,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.920,1.850],
"number_observations_unique": 3313,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.370
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 1.900
}
]
},
{
"resolution_limits": [1.990,1.920],
"number_observations_unique": 3205,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.254
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [2.080,1.990],
"number_observations_unique": 3273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [2.190,2.080],
"number_observations_unique": 3298,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [2.330,2.190],
"number_observations_unique": 3271,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.119
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [2.510,2.330],
"number_observations_unique": 3289,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [2.760,2.510],
"number_observations_unique": 3338,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [3.160,2.760],
"number_observations_unique": 3303,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [3.990,3.160],
"number_observations_unique": 3278,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [50.000,3.990],
"number_observations_unique": 3320,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 2.000
}
]
}
]
}